1-(4-chlorophenyl)sulfonyl-2,3-dihydroindole

C14H12ClNO2S — CID 710426

IUPAC1-(4-chlorophenyl)sulfonyl-2,3-dihydroindole
SMILESO=S(=O)(c1ccc(Cl)cc1)N1CCc2ccccc21
InChIInChI=1S/C14H12ClNO2S/c15-12-5-7-13(8-6-12)19(17,18)16-10-9-11-3-1-2-4-14(11)16/h1-8H,9-10H2
InChIKeyPJZOCOWIPWKJKD-UHFFFAOYSA-N
MW293.78 g/mol
LogP3.09
Rot. Bonds2

About 1-(4-chlorophenyl)sulfonyl-2,3-dihydroindole

1-(4-chlorophenyl)sulfonyl-2,3-dihydroindole (PubChem CID 710426) has the molecular formula C14H12ClNO2S and a molecular weight of 293.78 g/mol. Its IUPAC name is 1-(4-chlorophenyl)sulfonyl-2,3-dihydroindole.

Molecular Properties

Compound Name1-(4-chlorophenyl)sulfonyl-2,3-dihydroindole
PubChem CID710426
Molecular FormulaC14H12ClNO2S
Molecular Weight293.78 g/mol
Exact Mass293.03
IUPAC Name1-(4-chlorophenyl)sulfonyl-2,3-dihydroindole
SMILESO=S(=O)(c1ccc(Cl)cc1)N1CCc2ccccc21
InChIInChI=1S/C14H12ClNO2S/c15-12-5-7-13(8-6-12)19(17,18)16-10-9-11-3-1-2-4-14(11)16/h1-8H,9-10H2
InChIKeyPJZOCOWIPWKJKD-UHFFFAOYSA-N
XLogP3.09
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.78
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(4-chlorophenyl)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-Chloro-benzenesulfonyl)-1,2,3,4-tetrahydro-quinoline
CID 2843275
4-(2,3-Dihydro-1H-indole-1-sulfonyl)aniline
CID 576320
1-(Phenylsulfonyl)indoline
CID 668757
1-(4-Fluorophenyl)sulfonyl-2,3-dihydroindole
CID 768000
N-[(4-chlorophenyl)sulfonyl]-N-(2-methylphenyl)acetamide
CID 872494
4-chloro-N-ethyl-N-phenylbenzenesulfonamide
CID 668790
4-chloro-N-[[4-(diethylamino)phenyl]methyl]-N-(4-methylphenyl)benzenesulfonamide
CID 71584279
2,3-Dimethyl-1-(phenylsulfonyl)indoline
CID 252020
2,5-dichloro-N-ethyl-N-(2-methylphenyl)benzenesulfonamide
CID 796394
4-chloro-N-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-N-methylbenzenesulfonamide (non-preferred name)
CID 1301415
N-allyl-4-chloro-N-phenylbenzenesulfonamide
CID 2768894
N-[(2-chlorophenyl)methyl]-1-methanesulfonyl-2,3-dihydro-1H-indole-5-sulfonamide
CID 16031729

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)sulfonyl-2,3-dihydroindole?
The IUPAC name of 1-(4-chlorophenyl)sulfonyl-2,3-dihydroindole (CID 710426) is 1-(4-chlorophenyl)sulfonyl-2,3-dihydroindole.
What is the SMILES notation for 1-(4-chlorophenyl)sulfonyl-2,3-dihydroindole?
The canonical SMILES for 1-(4-chlorophenyl)sulfonyl-2,3-dihydroindole is O=S(=O)(c1ccc(Cl)cc1)N1CCc2ccccc21.
What is the InChIKey of 1-(4-chlorophenyl)sulfonyl-2,3-dihydroindole?
The InChIKey is PJZOCOWIPWKJKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClNO2S/c15-12-5-7-13(8-6-12)19(17,18)16-10-9-11-3-1-2-4-14(11)16/h1-8H,9-10H2.
What are the key properties of 1-(4-chlorophenyl)sulfonyl-2,3-dihydroindole?
1-(4-chlorophenyl)sulfonyl-2,3-dihydroindole has a molecular weight of 293.78 g/mol, XLogP of 3.09, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)sulfonyl-2,3-dihydroindole is sourced from PubChem (CID 710426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).