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Home> Encyclopedia > Hot Product Listed 7   > 7-Benzofurancarboxamide,4-amino-5-chloro-2,3-dihydro-N-[1-(3-methoxypropyl)-4-piperidinyl]-
179474-81-8 structure

7-Benzofurancarboxamide,4-amino-5-chloro-2,3-dihydro-N-[1-(3-methoxypropyl)-4-piperidinyl]-

Iupac Name:4-amino-5-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide
CAS No.:179474-81-8
EINECS(EC#): 1312995-182-4
Molecular Weight:367.874
Molecular Formula:C18H26ClN3O3 (isomer)
Names and Identifiers
Synonyms

0a09iuw5tp 4-amino-5-chloro-2,3-dihydro-benzofuran-7-carboxylic acid [1-(3-methoxy-propyl)-piperidin-4-yl]-amide 4-amino-5-chloro-2,3-dihydro-n-(1-(3-methoxypropyl)-4-piperidyl)-7-benzofurancarboxamide 4-amino-5-chloro-2,3-dihydro-n-[1-(3-methoxypropyl)-4-piperidinyl]-7-benzofurancarboxamide 4-amino-5-chloro-n-(1-(3-methoxypropyl)piperidin-4-yl)-2,3-dihydrobenzofuran-7-carboxamide 4-amino-5-chloro-n-[1-(3-methoxypropyl)-4-piperidyl]-2,3-dihydrobenzofuran-7-carboxamide 4-amino-5-chloro-n-[1-(3-methoxypropyl)piperidin-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide A25458 AB0035840 AB1008449 AC1MHJYO AC-23945 AK170477 AM84628 AN-3491 AS-19549 BCPP000099 bdbm50122872 c18h26cln3o3 CHEBI:135552 CHEMBL117287 CS-2574 D04QSJ D09205 D0F3ZT DB06480 DTXSID5057670 EX-A1333 HE064952 HMS3651F04 HY-14151 KB-80141 KS-000006NE L000891 LP077907 mfcd09837787 MOLPORT-009-679-441 NCGC00253867-01 NCGC00253867-02 prucalopride prucalopride (usan/inn) prucalopride(r-93877) Q-3828 r 093877 r093877 r-093877 r0-93877 resolor RL02293 S2875 SC-23104 SCHEMBL16952 sr-01000945275 SR-01000945275-1 Unii-0A09iuw5tp Y0251 ZINC1891034

Inchi
InChI=1S/C18H26ClN3O3/c1-24-9-2-6-22-7-3-12(4-8-22)21-18(23)14-11-15(19)16(20)13-5-10-25-17(13)14/h11-12H,2-10,20H2,1H3,(H,21,23)
InChkey
ZPMNHBXQOOVQJL-UHFFFAOYSA-N
Canonical Smiles
COCCCN1CCC(CC1)NC(=O)C2=CC(=C(C3=C2OCC3)N)Cl
Properties
Density
1.28
Melting Point
90.7°
Boiling Point
481.4°Cat760mmHg
Vapour
2E-09mmHg at 25°C
Refractive Index
1.599
Flash Point
244.9°C
Safety and Handling
Transport
UN 3077 9 / PGIII
Specification

   4-Amino-5-chloro-2,3-dihydro-N-[1-(3-methoxypropyl)-4-piperidinyl]-7-benzofurancarboxamide (CAS No.179474-81-8), its synonyms are 4-Amino-5-chloro-N-[1-(3-methoxypropyl)-4-piperidinyl]-2,3-dihydro-1-benzofuran-7-carboxamide ; 4-Amino-5-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide ; 7-Benzofurancarboxamide, 4-amino-5-chloro-2,3-dihydro-N-[1-(3-methoxypropyl)-4-piperidinyl]- ; 4-Amino-5-chloro-2,3-dihydro-benzofuran-7-carboxylic acid [1-(3-methoxy-propyl)-piperidin-4-yl]-amide ; 4-Amino-5-chloro-2,3-dihydro-N-(1-(3-methoxypropyl)-4-piperidyl)-7-benzofurancarboxamide .

MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

Computational chemical data
  • Molecular Weight:367.874g/mol
  • Molecular Formula:C18H26ClN3O3
  • Compound Is Canonicalized:True
  • Exact Mass:367.166
  • Monoisotopic Mass:367.166
  • Complexity:445
  • Rotatable Bond Count:6
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:5
  • Topological Polar Surface Area:76.8A^2
  • Heavy Atom Count:25
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADceB7MAAEAAAAAAAAAAAAAAAAASAAAAA8QAAAAAAAAEgBAAAAHgIQAAAADC7hmCYyxoPABACI AiVSUACCCAAkJQAAiIEMTsgMJjaF9puGOWjm9hmI6Ye42fGeCCACIgAKABAQQAREABQAIAAAAAAA AA==
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