N-(3-chloro-4-methyl-1H-indol-7-yl)-2-methyl-1,3-thiazole-4-sulfonamide

C13H12ClN3O2S2 — CID 172572464

IUPACN-(3-chloro-4-methyl-1H-indol-7-yl)-2-methyl-1,3-thiazole-4-sulfonamide
SMILESCc1nc(S(=O)(=O)Nc2ccc(C)c3c(Cl)c[nH]c23)cs1
InChIInChI=1S/C13H12ClN3O2S2/c1-7-3-4-10(13-12(7)9(14)5-15-13)17-21(18,19)11-6-20-8(2)16-11/h3-6,15,17H,1-2H3
InChIKeyMFCCRZACCIARLL-UHFFFAOYSA-N
MW341.85 g/mol
LogP3.70
Rot. Bonds3

About N-(3-chloro-4-methyl-1H-indol-7-yl)-2-methyl-1,3-thiazole-4-sulfonamide

N-(3-chloro-4-methyl-1H-indol-7-yl)-2-methyl-1,3-thiazole-4-sulfonamide (PubChem CID 172572464) has the molecular formula C13H12ClN3O2S2 and a molecular weight of 341.85 g/mol. Its IUPAC name is N-(3-chloro-4-methyl-1H-indol-7-yl)-2-methyl-1,3-thiazole-4-sulfonamide.

Molecular Properties

Compound NameN-(3-chloro-4-methyl-1H-indol-7-yl)-2-methyl-1,3-thiazole-4-sulfonamide
PubChem CID172572464
Molecular FormulaC13H12ClN3O2S2
Molecular Weight341.85 g/mol
Exact Mass341.01
IUPAC NameN-(3-chloro-4-methyl-1H-indol-7-yl)-2-methyl-1,3-thiazole-4-sulfonamide
SMILESCc1nc(S(=O)(=O)Nc2ccc(C)c3c(Cl)c[nH]c23)cs1
InChIInChI=1S/C13H12ClN3O2S2/c1-7-3-4-10(13-12(7)9(14)5-15-13)17-21(18,19)11-6-20-8(2)16-11/h3-6,15,17H,1-2H3
InChIKeyMFCCRZACCIARLL-UHFFFAOYSA-N
XLogP3.70
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.85
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(3-chloro-4-methyl-1H-indol-7-yl)-2-methyl-1,3-thiazole-4-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-(3,4-dichloro-1H-indol-7-yl)-2-methyl-5-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide
CID 164863451
4-N-(3-chloro-4-methyl-1H-indol-7-yl)-1-N-piperidin-4-ylbenzene-1,4-disulfonamide
CID 164863611
2-[(3-cyano-4-methyl-1H-indol-7-yl)sulfamoyl]-1,3-thiazole-4-carboxamide
CID 171055458
N-(3,4-dichloro-1H-indol-7-yl)-1H-pyrazole-4-sulfonamide
CID 155193461
4-N-(3,4-dichloro-1H-indol-7-yl)benzene-1,4-disulfonamide
CID 22228546
N-(3-cyano-4-methyl-1H-indol-7-yl)-4-(piperazine-1-carbonyl)-1,3-thiazole-2-sulfonamide
CID 171664622
2-[(3,4-dichloro-1H-indol-7-yl)sulfamoyl]benzenesulfonyl fluoride
CID 175760561
2-methyl-N-(2-methylphenyl)-5-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide
CID 15560939
N-(3-cyano-4-methyl-1H-indol-7-yl)-3-methyl-1,2-thiazole-5-sulfonamide
CID 171055436
5-bromo-N-(6-chloro-2-methyl-3-pyridinyl)-2-methylbenzenesulfonamide
CID 107266690
N-(3-ethynyl-4-methyl-1H-indol-7-yl)-4-propan-2-ylbenzenesulfonamide
CID 157165213
N-(3,4-dimethyl-1H-indol-7-yl)-2-nitrobenzenesulfonamide
CID 170407663

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methyl-1H-indol-7-yl)-2-methyl-1,3-thiazole-4-sulfonamide?
The IUPAC name of N-(3-chloro-4-methyl-1H-indol-7-yl)-2-methyl-1,3-thiazole-4-sulfonamide (CID 172572464) is N-(3-chloro-4-methyl-1H-indol-7-yl)-2-methyl-1,3-thiazole-4-sulfonamide.
What is the SMILES notation for N-(3-chloro-4-methyl-1H-indol-7-yl)-2-methyl-1,3-thiazole-4-sulfonamide?
The canonical SMILES for N-(3-chloro-4-methyl-1H-indol-7-yl)-2-methyl-1,3-thiazole-4-sulfonamide is Cc1nc(S(=O)(=O)Nc2ccc(C)c3c(Cl)c[nH]c23)cs1.
What is the InChIKey of N-(3-chloro-4-methyl-1H-indol-7-yl)-2-methyl-1,3-thiazole-4-sulfonamide?
The InChIKey is MFCCRZACCIARLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClN3O2S2/c1-7-3-4-10(13-12(7)9(14)5-15-13)17-21(18,19)11-6-20-8(2)16-11/h3-6,15,17H,1-2H3.
What are the key properties of N-(3-chloro-4-methyl-1H-indol-7-yl)-2-methyl-1,3-thiazole-4-sulfonamide?
N-(3-chloro-4-methyl-1H-indol-7-yl)-2-methyl-1,3-thiazole-4-sulfonamide has a molecular weight of 341.85 g/mol, XLogP of 3.70, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methyl-1H-indol-7-yl)-2-methyl-1,3-thiazole-4-sulfonamide is sourced from PubChem (CID 172572464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).