2-chloro-N-(2-imidazol-1-ylphenyl)-1,3-thiazole-5-sulfonamide

C12H9ClN4O2S2 — CID 61052341

IUPAC2-chloro-N-(2-imidazol-1-ylphenyl)-1,3-thiazole-5-sulfonamide
SMILESO=S(=O)(Nc1ccccc1-n1ccnc1)c1cnc(Cl)s1
InChIInChI=1S/C12H9ClN4O2S2/c13-12-15-7-11(20-12)21(18,19)16-9-3-1-2-4-10(9)17-6-5-14-8-17/h1-8,16H
InChIKeyBBGMAMSSQQIIOH-UHFFFAOYSA-N
MW340.82 g/mol
LogP2.78
Rot. Bonds4

About 2-chloro-N-(2-imidazol-1-ylphenyl)-1,3-thiazole-5-sulfonamide

2-chloro-N-(2-imidazol-1-ylphenyl)-1,3-thiazole-5-sulfonamide (PubChem CID 61052341) has the molecular formula C12H9ClN4O2S2 and a molecular weight of 340.82 g/mol. Its IUPAC name is 2-chloro-N-(2-imidazol-1-ylphenyl)-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(2-imidazol-1-ylphenyl)-1,3-thiazole-5-sulfonamide
PubChem CID61052341
Molecular FormulaC12H9ClN4O2S2
Molecular Weight340.82 g/mol
Exact Mass339.99
IUPAC Name2-chloro-N-(2-imidazol-1-ylphenyl)-1,3-thiazole-5-sulfonamide
SMILESO=S(=O)(Nc1ccccc1-n1ccnc1)c1cnc(Cl)s1
InChIInChI=1S/C12H9ClN4O2S2/c13-12-15-7-11(20-12)21(18,19)16-9-3-1-2-4-10(9)17-6-5-14-8-17/h1-8,16H
InChIKeyBBGMAMSSQQIIOH-UHFFFAOYSA-N
XLogP2.78
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.82
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-chloro-N-(2-imidazol-1-ylphenyl)-1,3-thiazole-5-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-imidazol-1-ylphenyl)benzenesulfonamide
CID 64592915
2-chloro-N-(2-chlorophenyl)-1,3-thiazole-5-sulfonamide
CID 43427443
2-chloro-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]-1,3-thiazole-5-sulfonamide
CID 61216389
2-chloro-N-(2-ethylphenyl)-1,3-thiazole-5-sulfonamide
CID 43455810
5-chloro-N-(2-imidazol-1-ylphenyl)thiophene-2-carboxamide
CID 47165423
2-[2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]phenyl]sulfanylacetamide
CID 61052007
4-chloro-N-(2-imidazol-1-ylphenyl)pyridine-3-carboxamide
CID 81228247
N-(4-bromophenyl)-2-chloro-1,3-thiazole-5-sulfonamide
CID 43427435
2-chloro-N-(2-chloro-5-iodophenyl)-1,3-thiazole-5-sulfonamide
CID 114259497
2-chloro-N-(3-chloro-2H-indazol-7-yl)-1,3-thiazole-5-sulfonamide
CID 170949514
2-chloro-N-(1-propan-2-ylpyrazol-3-yl)-1,3-thiazole-5-sulfonamide
CID 114251526
N-(1,3-benzothiazol-2-yl)-2-chloro-1,3-thiazole-5-sulfonamide
CID 43455882

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2-imidazol-1-ylphenyl)-1,3-thiazole-5-sulfonamide?
The IUPAC name of 2-chloro-N-(2-imidazol-1-ylphenyl)-1,3-thiazole-5-sulfonamide (CID 61052341) is 2-chloro-N-(2-imidazol-1-ylphenyl)-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 2-chloro-N-(2-imidazol-1-ylphenyl)-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 2-chloro-N-(2-imidazol-1-ylphenyl)-1,3-thiazole-5-sulfonamide is O=S(=O)(Nc1ccccc1-n1ccnc1)c1cnc(Cl)s1.
What is the InChIKey of 2-chloro-N-(2-imidazol-1-ylphenyl)-1,3-thiazole-5-sulfonamide?
The InChIKey is BBGMAMSSQQIIOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClN4O2S2/c13-12-15-7-11(20-12)21(18,19)16-9-3-1-2-4-10(9)17-6-5-14-8-17/h1-8,16H.
What are the key properties of 2-chloro-N-(2-imidazol-1-ylphenyl)-1,3-thiazole-5-sulfonamide?
2-chloro-N-(2-imidazol-1-ylphenyl)-1,3-thiazole-5-sulfonamide has a molecular weight of 340.82 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2-imidazol-1-ylphenyl)-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 61052341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).