1-(2-phenylphenyl)-3-(4-sulfamoylphenyl)urea

C19H17N3O3S — CID 51356010

IUPAC1-(2-phenylphenyl)-3-(4-sulfamoylphenyl)urea
SMILESNS(=O)(=O)c1ccc(NC(=O)Nc2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C19H17N3O3S/c20-26(24,25)16-12-10-15(11-13-16)21-19(23)22-18-9-5-4-8-17(18)14-6-2-1-3-7-14/h1-13H,(H2,20,24,25)(H2,21,22,23)
InChIKeyLRMYTINNXLFYRJ-UHFFFAOYSA-N
MW367.43 g/mol
LogP3.64
Rot. Bonds4

About 1-(2-phenylphenyl)-3-(4-sulfamoylphenyl)urea

1-(2-phenylphenyl)-3-(4-sulfamoylphenyl)urea (PubChem CID 51356010) has the molecular formula C19H17N3O3S and a molecular weight of 367.43 g/mol. Its IUPAC name is 1-(2-phenylphenyl)-3-(4-sulfamoylphenyl)urea.

Molecular Properties

Compound Name1-(2-phenylphenyl)-3-(4-sulfamoylphenyl)urea
PubChem CID51356010
Molecular FormulaC19H17N3O3S
Molecular Weight367.43 g/mol
Exact Mass367.10
IUPAC Name1-(2-phenylphenyl)-3-(4-sulfamoylphenyl)urea
SMILESNS(=O)(=O)c1ccc(NC(=O)Nc2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C19H17N3O3S/c20-26(24,25)16-12-10-15(11-13-16)21-19(23)22-18-9-5-4-8-17(18)14-6-2-1-3-7-14/h1-13H,(H2,20,24,25)(H2,21,22,23)
InChIKeyLRMYTINNXLFYRJ-UHFFFAOYSA-N
XLogP3.64
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.43
LogP ≤ 53.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-phenylphenyl)-3-(4-sulfamoylphenyl)urea?
The IUPAC name of 1-(2-phenylphenyl)-3-(4-sulfamoylphenyl)urea (CID 51356010) is 1-(2-phenylphenyl)-3-(4-sulfamoylphenyl)urea.
What is the SMILES notation for 1-(2-phenylphenyl)-3-(4-sulfamoylphenyl)urea?
The canonical SMILES for 1-(2-phenylphenyl)-3-(4-sulfamoylphenyl)urea is NS(=O)(=O)c1ccc(NC(=O)Nc2ccccc2-c2ccccc2)cc1.
What is the InChIKey of 1-(2-phenylphenyl)-3-(4-sulfamoylphenyl)urea?
The InChIKey is LRMYTINNXLFYRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O3S/c20-26(24,25)16-12-10-15(11-13-16)21-19(23)22-18-9-5-4-8-17(18)14-6-2-1-3-7-14/h1-13H,(H2,20,24,25)(H2,21,22,23).
What are the key properties of 1-(2-phenylphenyl)-3-(4-sulfamoylphenyl)urea?
1-(2-phenylphenyl)-3-(4-sulfamoylphenyl)urea has a molecular weight of 367.43 g/mol, XLogP of 3.64, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenylphenyl)-3-(4-sulfamoylphenyl)urea is sourced from PubChem (CID 51356010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).