1-(3-chloro-4-methoxyphenyl)sulfonyl-2,3-dihydroindole

C15H14ClNO3S — CID 974280

IUPAC1-(3-chloro-4-methoxyphenyl)sulfonyl-2,3-dihydroindole
SMILESCOc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1Cl
InChIInChI=1S/C15H14ClNO3S/c1-20-15-7-6-12(10-13(15)16)21(18,19)17-9-8-11-4-2-3-5-14(11)17/h2-7,10H,8-9H2,1H3
InChIKeyPTFYXCICJRQNLA-UHFFFAOYSA-N
MW323.80 g/mol
LogP3.10
Rot. Bonds3

About 1-(3-chloro-4-methoxyphenyl)sulfonyl-2,3-dihydroindole

1-(3-chloro-4-methoxyphenyl)sulfonyl-2,3-dihydroindole (PubChem CID 974280) has the molecular formula C15H14ClNO3S and a molecular weight of 323.80 g/mol. Its IUPAC name is 1-(3-chloro-4-methoxyphenyl)sulfonyl-2,3-dihydroindole.

Molecular Properties

Compound Name1-(3-chloro-4-methoxyphenyl)sulfonyl-2,3-dihydroindole
PubChem CID974280
Molecular FormulaC15H14ClNO3S
Molecular Weight323.80 g/mol
Exact Mass323.04
IUPAC Name1-(3-chloro-4-methoxyphenyl)sulfonyl-2,3-dihydroindole
SMILESCOc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1Cl
InChIInChI=1S/C15H14ClNO3S/c1-20-15-7-6-12(10-13(15)16)21(18,19)17-9-8-11-4-2-3-5-14(11)17/h2-7,10H,8-9H2,1H3
InChIKeyPTFYXCICJRQNLA-UHFFFAOYSA-N
XLogP3.10
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.80
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(3-chloro-4-methoxyphenyl)sulfonyl-2,3-dihydroindole 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

1-(4-methoxy-3-methylphenyl)sulfonyl-2,3-dihydroindole
CID 2226308
1-(3-chloro-4-methoxyphenyl)sulfonyl-2,3-dihydroquinolin-4-one
CID 110604097
5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxybenzoic acid
CID 832238
[5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxyphenyl]-(4-methylpiperazin-1-yl)methanone
CID 55334797
5-(2,3-dihydroindol-1-ylsulfonyl)-N,N-diethyl-2-methoxybenzamide
CID 33237289
methyl 2-[[2-[2-chloro-4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]acetyl]amino]benzoate
CID 126396064
2-[2-chloro-4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-1-(2-methyl-2,3-dihydroindol-1-yl)ethanone
CID 133239020
2-[2-chloro-4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-(2,6-diethylphenyl)acetamide
CID 126394310
2-[2-chloro-4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-cyclohexylacetamide
CID 6491405
1-(5-bromo-2-methoxyphenyl)sulfonyl-2,3-dihydroindole
CID 3779020
1-(3-fluoro-4-propan-2-yloxyphenyl)sulfonyl-2,3-dihydroindole
CID 110758239
1-(3-chloro-4-methoxyphenyl)sulfonyl-6-fluoro-2,3-dihydroquinolin-4-one
CID 110635146

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-4-methoxyphenyl)sulfonyl-2,3-dihydroindole?
The IUPAC name of 1-(3-chloro-4-methoxyphenyl)sulfonyl-2,3-dihydroindole (CID 974280) is 1-(3-chloro-4-methoxyphenyl)sulfonyl-2,3-dihydroindole.
What is the SMILES notation for 1-(3-chloro-4-methoxyphenyl)sulfonyl-2,3-dihydroindole?
The canonical SMILES for 1-(3-chloro-4-methoxyphenyl)sulfonyl-2,3-dihydroindole is COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1Cl.
What is the InChIKey of 1-(3-chloro-4-methoxyphenyl)sulfonyl-2,3-dihydroindole?
The InChIKey is PTFYXCICJRQNLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO3S/c1-20-15-7-6-12(10-13(15)16)21(18,19)17-9-8-11-4-2-3-5-14(11)17/h2-7,10H,8-9H2,1H3.
What are the key properties of 1-(3-chloro-4-methoxyphenyl)sulfonyl-2,3-dihydroindole?
1-(3-chloro-4-methoxyphenyl)sulfonyl-2,3-dihydroindole has a molecular weight of 323.80 g/mol, XLogP of 3.10, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-4-methoxyphenyl)sulfonyl-2,3-dihydroindole is sourced from PubChem (CID 974280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).