(2R)-2-[(4-phenylphenyl)sulfonylamino]propanoic acid

C15H15NO4S — CID 24901481

IUPAC(2R)-2-[(4-phenylphenyl)sulfonylamino]propanoic acid
SMILESC[C@@H](NS(=O)(=O)c1ccc(-c2ccccc2)cc1)C(=O)O
InChIInChI=1S/C15H15NO4S/c1-11(15(17)18)16-21(19,20)14-9-7-13(8-10-14)12-5-3-2-4-6-12/h2-11,16H,1H3,(H,17,18)/t11-/m1/s1
InChIKeyKXVXZFCETOKHTC-LLVKDONJSA-N
MW305.36 g/mol
LogP2.11
Rot. Bonds5

About (2R)-2-[(4-phenylphenyl)sulfonylamino]propanoic acid

(2R)-2-[(4-phenylphenyl)sulfonylamino]propanoic acid (PubChem CID 24901481) has the molecular formula C15H15NO4S and a molecular weight of 305.36 g/mol. Its IUPAC name is (2R)-2-[(4-phenylphenyl)sulfonylamino]propanoic acid.

Molecular Properties

Compound Name(2R)-2-[(4-phenylphenyl)sulfonylamino]propanoic acid
PubChem CID24901481
Molecular FormulaC15H15NO4S
Molecular Weight305.36 g/mol
Exact Mass305.07
IUPAC Name(2R)-2-[(4-phenylphenyl)sulfonylamino]propanoic acid
SMILESC[C@@H](NS(=O)(=O)c1ccc(-c2ccccc2)cc1)C(=O)O
InChIInChI=1S/C15H15NO4S/c1-11(15(17)18)16-21(19,20)14-9-7-13(8-10-14)12-5-3-2-4-6-12/h2-11,16H,1H3,(H,17,18)/t11-/m1/s1
InChIKeyKXVXZFCETOKHTC-LLVKDONJSA-N
XLogP2.11
TPSA83.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2R)-2-[(4-phenylphenyl)sulfonylamino]propanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(4-phenylphenyl)sulfonylamino]propanoic acid?
The IUPAC name of (2R)-2-[(4-phenylphenyl)sulfonylamino]propanoic acid (CID 24901481) is (2R)-2-[(4-phenylphenyl)sulfonylamino]propanoic acid.
What is the SMILES notation for (2R)-2-[(4-phenylphenyl)sulfonylamino]propanoic acid?
The canonical SMILES for (2R)-2-[(4-phenylphenyl)sulfonylamino]propanoic acid is C[C@@H](NS(=O)(=O)c1ccc(-c2ccccc2)cc1)C(=O)O.
What is the InChIKey of (2R)-2-[(4-phenylphenyl)sulfonylamino]propanoic acid?
The InChIKey is KXVXZFCETOKHTC-LLVKDONJSA-N. The full InChI is InChI=1S/C15H15NO4S/c1-11(15(17)18)16-21(19,20)14-9-7-13(8-10-14)12-5-3-2-4-6-12/h2-11,16H,1H3,(H,17,18)/t11-/m1/s1.
What are the key properties of (2R)-2-[(4-phenylphenyl)sulfonylamino]propanoic acid?
(2R)-2-[(4-phenylphenyl)sulfonylamino]propanoic acid has a molecular weight of 305.36 g/mol, XLogP of 2.11, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(4-phenylphenyl)sulfonylamino]propanoic acid is sourced from PubChem (CID 24901481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).