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Home > Indoles and Oxindole > 676477-29-5
676477-29-5 | 1H-Indole-3-carboxamide, 6-chloro-1-(cyclopropylmethyl)-N-2-thiazolyl-
CAS No: 676477-29-5 Catalog No: AG005R0W MDL No:
Product Description
Catalog Number:
AG005R0W
Chemical Name:
1H-Indole-3-carboxamide, 6-chloro-1-(cyclopropylmethyl)-N-2-thiazolyl-
CAS Number:
676477-29-5
Molecular Formula:
C16H14ClN3OS
Molecular Weight:
331.8199
IUPAC Name:
6-chloro-1-(cyclopropylmethyl)-N-(1,3-thiazol-2-yl)indole-3-carboxamide
InChI:
InChI=1S/C16H14ClN3OS/c17-11-3-4-12-13(15(21)19-16-18-5-6-22-16)9-20(14(12)7-11)8-10-1-2-10/h3-7,9-10H,1-2,8H2,(H,18,19,21)
InChI Key:
LXPSBBCFDOCISE-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)n(CC1CC1)cc2C(=O)Nc1nccs1
Properties
Complexity:
434
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.055g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
331.818g/mol
Monoisotopic Mass:
331.055g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
75.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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