6-(naphthalen-1-ylsulfonylamino)-1H-indole-7-carboxylic acid

C19H14N2O4S — CID 68865000

IUPAC6-(naphthalen-1-ylsulfonylamino)-1H-indole-7-carboxylic acid
SMILESO=C(O)c1c(NS(=O)(=O)c2cccc3ccccc23)ccc2cc[nH]c12
InChIInChI=1S/C19H14N2O4S/c22-19(23)17-15(9-8-13-10-11-20-18(13)17)21-26(24,25)16-7-3-5-12-4-1-2-6-14(12)16/h1-11,20-21H,(H,22,23)
InChIKeyVEOSYHZOXTYLPQ-UHFFFAOYSA-N
MW366.40 g/mol
LogP3.82
Rot. Bonds4

About 6-(naphthalen-1-ylsulfonylamino)-1H-indole-7-carboxylic acid

6-(naphthalen-1-ylsulfonylamino)-1H-indole-7-carboxylic acid (PubChem CID 68865000) has the molecular formula C19H14N2O4S and a molecular weight of 366.40 g/mol. Its IUPAC name is 6-(naphthalen-1-ylsulfonylamino)-1H-indole-7-carboxylic acid.

Molecular Properties

Compound Name6-(naphthalen-1-ylsulfonylamino)-1H-indole-7-carboxylic acid
PubChem CID68865000
Molecular FormulaC19H14N2O4S
Molecular Weight366.40 g/mol
Exact Mass366.07
IUPAC Name6-(naphthalen-1-ylsulfonylamino)-1H-indole-7-carboxylic acid
SMILESO=C(O)c1c(NS(=O)(=O)c2cccc3ccccc23)ccc2cc[nH]c12
InChIInChI=1S/C19H14N2O4S/c22-19(23)17-15(9-8-13-10-11-20-18(13)17)21-26(24,25)16-7-3-5-12-4-1-2-6-14(12)16/h1-11,20-21H,(H,22,23)
InChIKeyVEOSYHZOXTYLPQ-UHFFFAOYSA-N
XLogP3.82
TPSA99.26 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.40
LogP ≤ 53.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 6-(naphthalen-1-ylsulfonylamino)-1H-indole-7-carboxylic 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

6-[(2-chloro-4-methoxyphenyl)sulfonylamino]-1H-indole-7-carboxylic acid
CID 68866331
4-(1H-indol-7-ylsulfamoyl)benzoic acid
CID 22228599
5-bromo-2-(naphthalen-1-ylsulfonylamino)benzoic acid
CID 68865312
N-(2-acetyl-3-chlorophenyl)naphthalene-1-sulfonamide
CID 22888906
2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)naphthalene-1-carboxylic acid
CID 10000157
2-[[2-(3,3-dimethylbutylamino)phenyl]sulfonylamino]naphthalene-1-carboxylic acid
CID 68864170
2-[2-[2-(naphthalen-1-ylsulfonylamino)phenyl]ethyl]benzoic acid
CID 68691994
N-phenylnaphthalene-1-sulfonamide
CID 3816137
2-[(4-chlorophenyl)sulfonylamino]naphthalene-1-carboxylic acid
CID 10044144
N-(4-bromonaphthalen-1-yl)naphthalene-1-sulfonamide
CID 3666979
2-[[2-(2-propan-2-yloxyethylamino)phenyl]sulfonylamino]naphthalene-1-carboxylic acid
CID 68864527
N-[4,5-dibromo-2-(naphthalen-1-ylsulfonylamino)phenyl]naphthalene-1-sulfonamide
CID 139947697

Frequently Asked Questions

What is the IUPAC name of 6-(naphthalen-1-ylsulfonylamino)-1H-indole-7-carboxylic acid?
The IUPAC name of 6-(naphthalen-1-ylsulfonylamino)-1H-indole-7-carboxylic acid (CID 68865000) is 6-(naphthalen-1-ylsulfonylamino)-1H-indole-7-carboxylic acid.
What is the SMILES notation for 6-(naphthalen-1-ylsulfonylamino)-1H-indole-7-carboxylic acid?
The canonical SMILES for 6-(naphthalen-1-ylsulfonylamino)-1H-indole-7-carboxylic acid is O=C(O)c1c(NS(=O)(=O)c2cccc3ccccc23)ccc2cc[nH]c12.
What is the InChIKey of 6-(naphthalen-1-ylsulfonylamino)-1H-indole-7-carboxylic acid?
The InChIKey is VEOSYHZOXTYLPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O4S/c22-19(23)17-15(9-8-13-10-11-20-18(13)17)21-26(24,25)16-7-3-5-12-4-1-2-6-14(12)16/h1-11,20-21H,(H,22,23).
What are the key properties of 6-(naphthalen-1-ylsulfonylamino)-1H-indole-7-carboxylic acid?
6-(naphthalen-1-ylsulfonylamino)-1H-indole-7-carboxylic acid has a molecular weight of 366.40 g/mol, XLogP of 3.82, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(naphthalen-1-ylsulfonylamino)-1H-indole-7-carboxylic acid is sourced from PubChem (CID 68865000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).