[2-[[1-[(2-methoxyphenyl)sulfonylamino]-2,3-dihydro-1H-indene-5-carbonyl]amino]phenyl]carbamic acid

C24H23N3O6S — CID 68945548

IUPAC[2-[[1-[(2-methoxyphenyl)sulfonylamino]-2,3-dihydro-1H-indene-5-carbonyl]amino]phenyl]carbamic acid
SMILESCOc1ccccc1S(=O)(=O)NC1CCc2cc(C(=O)Nc3ccccc3NC(=O)O)ccc21
InChIInChI=1S/C24H23N3O6S/c1-33-21-8-4-5-9-22(21)34(31,32)27-18-13-11-15-14-16(10-12-17(15)18)23(28)25-19-6-2-3-7-20(19)26-24(29)30/h2-10,12,14,18,26-27H,11,13H2,1H3,(H,25,28)(H,29,30)
InChIKeyZIOBBVTZBCBJBZ-UHFFFAOYSA-N
MW481.53 g/mol
LogP4.00
Rot. Bonds7

About [2-[[1-[(2-methoxyphenyl)sulfonylamino]-2,3-dihydro-1H-indene-5-carbonyl]amino]phenyl]carbamic acid

[2-[[1-[(2-methoxyphenyl)sulfonylamino]-2,3-dihydro-1H-indene-5-carbonyl]amino]phenyl]carbamic acid (PubChem CID 68945548) has the molecular formula C24H23N3O6S and a molecular weight of 481.53 g/mol. Its IUPAC name is [2-[[1-[(2-methoxyphenyl)sulfonylamino]-2,3-dihydro-1H-indene-5-carbonyl]amino]phenyl]carbamic acid.

Molecular Properties

Compound Name[2-[[1-[(2-methoxyphenyl)sulfonylamino]-2,3-dihydro-1H-indene-5-carbonyl]amino]phenyl]carbamic acid
PubChem CID68945548
Molecular FormulaC24H23N3O6S
Molecular Weight481.53 g/mol
Exact Mass481.13
IUPAC Name[2-[[1-[(2-methoxyphenyl)sulfonylamino]-2,3-dihydro-1H-indene-5-carbonyl]amino]phenyl]carbamic acid
SMILESCOc1ccccc1S(=O)(=O)NC1CCc2cc(C(=O)Nc3ccccc3NC(=O)O)ccc21
InChIInChI=1S/C24H23N3O6S/c1-33-21-8-4-5-9-22(21)34(31,32)27-18-13-11-15-14-16(10-12-17(15)18)23(28)25-19-6-2-3-7-20(19)26-24(29)30/h2-10,12,14,18,26-27H,11,13H2,1H3,(H,25,28)(H,29,30)
InChIKeyZIOBBVTZBCBJBZ-UHFFFAOYSA-N
XLogP4.00
TPSA133.83 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500481.53
LogP ≤ 54.00
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze [2-[[1-[(2-methoxyphenyl)sulfonylamino]-2,3-dihydro-1H-indene-5-carbonyl]amino]phenyl]carbamic acid 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

3-cyclopropyl-4-methoxy-N-(2-methylsulfonylphenyl)benzamide
CID 154754687
3-(cyclopentylsulfamoyl)-N-(2,3-dimethylphenyl)-4-methoxybenzamide
CID 26915050
N-(2,3-dihydro-1H-inden-1-yl)-2-fluoro-4,5-dimethoxybenzenesulfonamide
CID 55598185
N-(2-bromophenyl)-3-(cyclopentylsulfamoyl)-4-methoxybenzamide
CID 26536733
N-(5-amino-2-methylphenyl)-3-(cyclopropylsulfamoyl)-4-methoxybenzamide
CID 120569275
N-(2,3-dihydro-1H-inden-1-yl)-4-methoxy-3-(2-methoxyethylsulfamoyl)benzamide
CID 24560488
4-acetyl-N-(5,6-dimethoxy-2,3-dihydro-1H-inden-1-yl)benzenesulfonamide
CID 110399781
3-acetyl-N-(5,6-dimethoxy-2,3-dihydro-1H-inden-1-yl)benzenesulfonamide
CID 110399780
N-(2,3-dimethylphenyl)-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide
CID 2687808
N-[2-(methanesulfonamido)phenyl]-3-methoxy-4-methylbenzamide
CID 35368704
N-(2,3-dihydro-1H-inden-1-yl)-4-methoxy-3-(2-methylpropylsulfamoyl)benzamide
CID 20649308
4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-[2-(trifluoromethoxy)phenyl]benzamide
CID 46644366

Frequently Asked Questions

What is the IUPAC name of [2-[[1-[(2-methoxyphenyl)sulfonylamino]-2,3-dihydro-1H-indene-5-carbonyl]amino]phenyl]carbamic acid?
The IUPAC name of [2-[[1-[(2-methoxyphenyl)sulfonylamino]-2,3-dihydro-1H-indene-5-carbonyl]amino]phenyl]carbamic acid (CID 68945548) is [2-[[1-[(2-methoxyphenyl)sulfonylamino]-2,3-dihydro-1H-indene-5-carbonyl]amino]phenyl]carbamic acid.
What is the SMILES notation for [2-[[1-[(2-methoxyphenyl)sulfonylamino]-2,3-dihydro-1H-indene-5-carbonyl]amino]phenyl]carbamic acid?
The canonical SMILES for [2-[[1-[(2-methoxyphenyl)sulfonylamino]-2,3-dihydro-1H-indene-5-carbonyl]amino]phenyl]carbamic acid is COc1ccccc1S(=O)(=O)NC1CCc2cc(C(=O)Nc3ccccc3NC(=O)O)ccc21.
What is the InChIKey of [2-[[1-[(2-methoxyphenyl)sulfonylamino]-2,3-dihydro-1H-indene-5-carbonyl]amino]phenyl]carbamic acid?
The InChIKey is ZIOBBVTZBCBJBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O6S/c1-33-21-8-4-5-9-22(21)34(31,32)27-18-13-11-15-14-16(10-12-17(15)18)23(28)25-19-6-2-3-7-20(19)26-24(29)30/h2-10,12,14,18,26-27H,11,13H2,1H3,(H,25,28)(H,29,30).
What are the key properties of [2-[[1-[(2-methoxyphenyl)sulfonylamino]-2,3-dihydro-1H-indene-5-carbonyl]amino]phenyl]carbamic acid?
[2-[[1-[(2-methoxyphenyl)sulfonylamino]-2,3-dihydro-1H-indene-5-carbonyl]amino]phenyl]carbamic acid has a molecular weight of 481.53 g/mol, XLogP of 4.00, 7 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[1-[(2-methoxyphenyl)sulfonylamino]-2,3-dihydro-1H-indene-5-carbonyl]amino]phenyl]carbamic acid is sourced from PubChem (CID 68945548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).