N-(2-bromo-3-chlorophenyl)-5-cyanothiophene-2-sulfonamide

C11H6BrClN2O2S2 — CID 106269296

IUPACN-(2-bromo-3-chlorophenyl)-5-cyanothiophene-2-sulfonamide
SMILESN#Cc1ccc(S(=O)(=O)Nc2cccc(Cl)c2Br)s1
InChIInChI=1S/C11H6BrClN2O2S2/c12-11-8(13)2-1-3-9(11)15-19(16,17)10-5-4-7(6-14)18-10/h1-5,15H
InChIKeyDNQBDRYHTLARMA-UHFFFAOYSA-N
MW377.67 g/mol
LogP3.84
Rot. Bonds3

About N-(2-bromo-3-chlorophenyl)-5-cyanothiophene-2-sulfonamide

N-(2-bromo-3-chlorophenyl)-5-cyanothiophene-2-sulfonamide (PubChem CID 106269296) has the molecular formula C11H6BrClN2O2S2 and a molecular weight of 377.67 g/mol. Its IUPAC name is N-(2-bromo-3-chlorophenyl)-5-cyanothiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(2-bromo-3-chlorophenyl)-5-cyanothiophene-2-sulfonamide
PubChem CID106269296
Molecular FormulaC11H6BrClN2O2S2
Molecular Weight377.67 g/mol
Exact Mass375.87
IUPAC NameN-(2-bromo-3-chlorophenyl)-5-cyanothiophene-2-sulfonamide
SMILESN#Cc1ccc(S(=O)(=O)Nc2cccc(Cl)c2Br)s1
InChIInChI=1S/C11H6BrClN2O2S2/c12-11-8(13)2-1-3-9(11)15-19(16,17)10-5-4-7(6-14)18-10/h1-5,15H
InChIKeyDNQBDRYHTLARMA-UHFFFAOYSA-N
XLogP3.84
TPSA69.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.67
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-bromo-5-chlorophenyl)-5-cyanothiophene-2-sulfonamide
CID 106268722
5-cyano-N-naphthalen-1-ylthiophene-2-sulfonamide
CID 106266893
5-cyano-N-(2-methylsulfanylphenyl)thiophene-2-sulfonamide
CID 106269401
3-[(5-cyanothiophen-2-yl)sulfonylamino]-2-hydroxybenzoic acid
CID 106265871
N-(2-bromo-4-fluorophenyl)-5-cyanothiophene-2-sulfonamide
CID 106267209
N-(2-bromo-3-chlorophenyl)-4-(cyanomethyl)benzenesulfonamide
CID 103479577
N-(2-bromo-3-chlorophenyl)-4-cyano-2-methylbenzenesulfonamide
CID 103522055
N-(3-chloro-5-fluoro-2-hydroxyphenyl)-5-cyanothiophene-2-sulfonamide
CID 106272334
N-(2-bromo-6-chloro-4-fluorophenyl)-5-cyanothiophene-2-sulfonamide
CID 106269382
N-(6-chloro-2-methyl-3-pyridinyl)-5-cyanothiophene-2-sulfonamide
CID 106273443
N-(3-chloro-4-hydroxyphenyl)-5-cyanothiophene-2-sulfonamide
CID 106272309
N-(3-chloro-4-fluorophenyl)-5-cyanothiophene-2-sulfonamide
CID 106267208

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-3-chlorophenyl)-5-cyanothiophene-2-sulfonamide?
The IUPAC name of N-(2-bromo-3-chlorophenyl)-5-cyanothiophene-2-sulfonamide (CID 106269296) is N-(2-bromo-3-chlorophenyl)-5-cyanothiophene-2-sulfonamide.
What is the SMILES notation for N-(2-bromo-3-chlorophenyl)-5-cyanothiophene-2-sulfonamide?
The canonical SMILES for N-(2-bromo-3-chlorophenyl)-5-cyanothiophene-2-sulfonamide is N#Cc1ccc(S(=O)(=O)Nc2cccc(Cl)c2Br)s1.
What is the InChIKey of N-(2-bromo-3-chlorophenyl)-5-cyanothiophene-2-sulfonamide?
The InChIKey is DNQBDRYHTLARMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6BrClN2O2S2/c12-11-8(13)2-1-3-9(11)15-19(16,17)10-5-4-7(6-14)18-10/h1-5,15H.
What are the key properties of N-(2-bromo-3-chlorophenyl)-5-cyanothiophene-2-sulfonamide?
N-(2-bromo-3-chlorophenyl)-5-cyanothiophene-2-sulfonamide has a molecular weight of 377.67 g/mol, XLogP of 3.84, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-3-chlorophenyl)-5-cyanothiophene-2-sulfonamide is sourced from PubChem (CID 106269296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).