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Home > Indoles and Oxindole > 100487-33-0
100487-33-0 | 1H-Indole-1-carboxamide, N-benzoyl-5-chloro-2,3-dihydro-2-oxo-
CAS No: 100487-33-0 Catalog No: AG00023I MDL No:
Product Description
Catalog Number:
AG00023I
Chemical Name:
1H-Indole-1-carboxamide, N-benzoyl-5-chloro-2,3-dihydro-2-oxo-
CAS Number:
100487-33-0
Molecular Formula:
C16H11ClN2O3
Molecular Weight:
314.7231
IUPAC Name:
N-benzoyl-5-chloro-2-oxo-3H-indole-1-carboxamide
InChI:
InChI=1S/C16H11ClN2O3/c17-12-6-7-13-11(8-12)9-14(20)19(13)16(22)18-15(21)10-4-2-1-3-5-10/h1-8H,9H2,(H,18,21,22)
InChI Key:
STXAKVBORIZJMR-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)CC(=O)N2C(=O)NC(=O)c1ccccc1
Properties
Complexity:
476
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.046g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
314.725g/mol
Monoisotopic Mass:
314.046g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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