(2-phenylphenyl)sulfonylcarbamic acid

C13H11NO4S — CID 23312596

IUPAC(2-phenylphenyl)sulfonylcarbamic acid
SMILESO=C(O)NS(=O)(=O)c1ccccc1-c1ccccc1
InChIInChI=1S/C13H11NO4S/c15-13(16)14-19(17,18)12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,14H,(H,15,16)
InChIKeyNEAIKMIJKPOSRP-UHFFFAOYSA-N
MW277.30 g/mol
LogP2.31
Rot. Bonds3

About (2-phenylphenyl)sulfonylcarbamic acid

(2-phenylphenyl)sulfonylcarbamic acid (PubChem CID 23312596) has the molecular formula C13H11NO4S and a molecular weight of 277.30 g/mol. Its IUPAC name is (2-phenylphenyl)sulfonylcarbamic acid.

Molecular Properties

Compound Name(2-phenylphenyl)sulfonylcarbamic acid
PubChem CID23312596
Molecular FormulaC13H11NO4S
Molecular Weight277.30 g/mol
Exact Mass277.04
IUPAC Name(2-phenylphenyl)sulfonylcarbamic acid
SMILESO=C(O)NS(=O)(=O)c1ccccc1-c1ccccc1
InChIInChI=1S/C13H11NO4S/c15-13(16)14-19(17,18)12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,14H,(H,15,16)
InChIKeyNEAIKMIJKPOSRP-UHFFFAOYSA-N
XLogP2.31
TPSA83.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.30
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2-phenylphenyl)sulfonylcarbamic 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

N-(2-hydroxyethyl)-2-phenylbenzenesulfonamide
CID 154485495
1-[(4-fluorophenyl)methyl]-3-(2-phenylphenyl)sulfonylurea
CID 142661395
2-(4-phenylphenyl)benzenesulfonic acid
CID 19793885
3-[(2-phenylphenyl)sulfonylamino]benzoic acid
CID 52565138
2-methyl-3-[(2-phenylphenyl)sulfonylamino]benzamide
CID 39846336
6-bromo-4-methyl-N-(2-phenylphenyl)sulfonyl-1-benzofuran-2-carboxamide
CID 155234394
methyl-(2-phenylphenyl)sulfonylazanide
CID 59280748
ethyl 4-[(2-phenylphenyl)sulfonylamino]butanoate
CID 134061973
2,5-dimethyl-N'-(2-phenylphenyl)sulfonylfuran-3-carbohydrazide
CID 134040433
chromium(6+);hexakis(octalene-1-sulfonate)
CID 157485438
azulene-1-sulfonic acid
CID 159727462
N-[2-(3-methylphenyl)phenyl]sulfonyl-3-[phenyl-(1-phenylethylamino)methyl]benzamide
CID 139791661

Frequently Asked Questions

What is the IUPAC name of (2-phenylphenyl)sulfonylcarbamic acid?
The IUPAC name of (2-phenylphenyl)sulfonylcarbamic acid (CID 23312596) is (2-phenylphenyl)sulfonylcarbamic acid.
What is the SMILES notation for (2-phenylphenyl)sulfonylcarbamic acid?
The canonical SMILES for (2-phenylphenyl)sulfonylcarbamic acid is O=C(O)NS(=O)(=O)c1ccccc1-c1ccccc1.
What is the InChIKey of (2-phenylphenyl)sulfonylcarbamic acid?
The InChIKey is NEAIKMIJKPOSRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11NO4S/c15-13(16)14-19(17,18)12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,14H,(H,15,16).
What are the key properties of (2-phenylphenyl)sulfonylcarbamic acid?
(2-phenylphenyl)sulfonylcarbamic acid has a molecular weight of 277.30 g/mol, XLogP of 2.31, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenylphenyl)sulfonylcarbamic acid is sourced from PubChem (CID 23312596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).