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Home > Indoles and Oxindole > 100599-27-7
100599-27-7 | 1H-Indole-1-carboxamide, 5-chloro-2,3-dihydro-2-oxo-3-(2-thienylcarbonyl)-
CAS No: 100599-27-7 Catalog No: AG0002F0 MDL No:
Product Description
Catalog Number:
AG0002F0
Chemical Name:
1H-Indole-1-carboxamide, 5-chloro-2,3-dihydro-2-oxo-3-(2-thienylcarbonyl)-
CAS Number:
100599-27-7
Molecular Formula:
C14H9ClN2O3S
Molecular Weight:
320.7509
IUPAC Name:
5-chloro-2-oxo-3-(thiophene-2-carbonyl)-3H-indole-1-carboxamide
InChI:
InChI=1S/C14H9ClN2O3S/c15-7-3-4-9-8(6-7)11(13(19)17(9)14(16)20)12(18)10-2-1-5-21-10/h1-6,11H,(H2,16,20)
InChI Key:
IGPDWKCUDHIIRL-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)C(C(=O)N2C(=O)N)C(=O)c1cccs1
Properties
Complexity:
487
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.002g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
320.747g/mol
Monoisotopic Mass:
320.002g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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