N-[4-chloro-3-[(2-chlorophenyl)sulfamoyl]phenyl]prop-2-enamide

C15H12Cl2N2O3S — CID 167764718

IUPACN-[4-chloro-3-[(2-chlorophenyl)sulfamoyl]phenyl]prop-2-enamide
SMILESC=CC(=O)Nc1ccc(Cl)c(S(=O)(=O)Nc2ccccc2Cl)c1
InChIInChI=1S/C15H12Cl2N2O3S/c1-2-15(20)18-10-7-8-12(17)14(9-10)23(21,22)19-13-6-4-3-5-11(13)16/h2-9,19H,1H2,(H,18,20)
InChIKeyYHFJURZHBXJMNO-UHFFFAOYSA-N
MW371.25 g/mol
LogP3.92
Rot. Bonds5

About N-[4-chloro-3-[(2-chlorophenyl)sulfamoyl]phenyl]prop-2-enamide

N-[4-chloro-3-[(2-chlorophenyl)sulfamoyl]phenyl]prop-2-enamide (PubChem CID 167764718) has the molecular formula C15H12Cl2N2O3S and a molecular weight of 371.25 g/mol. Its IUPAC name is N-[4-chloro-3-[(2-chlorophenyl)sulfamoyl]phenyl]prop-2-enamide.

Molecular Properties

Compound NameN-[4-chloro-3-[(2-chlorophenyl)sulfamoyl]phenyl]prop-2-enamide
PubChem CID167764718
Molecular FormulaC15H12Cl2N2O3S
Molecular Weight371.25 g/mol
Exact Mass369.99
IUPAC NameN-[4-chloro-3-[(2-chlorophenyl)sulfamoyl]phenyl]prop-2-enamide
SMILESC=CC(=O)Nc1ccc(Cl)c(S(=O)(=O)Nc2ccccc2Cl)c1
InChIInChI=1S/C15H12Cl2N2O3S/c1-2-15(20)18-10-7-8-12(17)14(9-10)23(21,22)19-13-6-4-3-5-11(13)16/h2-9,19H,1H2,(H,18,20)
InChIKeyYHFJURZHBXJMNO-UHFFFAOYSA-N
XLogP3.92
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.25
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze N-[4-chloro-3-[(2-chlorophenyl)sulfamoyl]phenyl]prop-2-enamide 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

Acetamide, N-(4-(aminosulfonyl)-2-chlorophenyl)-
CID 2795990
5-amino-2-chloro-N-(2-chlorophenyl)benzene-1-sulfonamide
CID 3822591
2-chloro-N-[4-chloro-3-(dimethylsulfamoyl)phenyl]acetamide
CID 3860347
N-(4-((2-Chloroanilino)sulfonyl)phenyl)acetamide
CID 607660
N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]acetamide
CID 720082
2-chloro-N-[4-chloro-3-(propan-2-ylsulfamoyl)phenyl]acetamide
CID 138857440
1-(4-Chlorophenyl)-3-(3-sulfamoylphenyl)urea
CID 4157467
N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]cyclopropanecarboxamide
CID 4881219
(E)-2,3-dichloro-N-(2-chlorophenyl)-3-(phenylsulfinyl)-2-propenamide
CID 1473969
N-[4-[(2,6-dichlorophenyl)sulfonylamino]phenyl]acetamide
CID 2109228
N-(4-{[(2-chloro-5-nitrophenyl)sulfonyl]amino}phenyl)acetamide
CID 2850112
N-[4-chloro-3-(dimethylsulfamoyl)phenyl]-2-(4-phenylpiperazin-1-yl)acetamide
CID 3954803

Frequently Asked Questions

What is the IUPAC name of N-[4-chloro-3-[(2-chlorophenyl)sulfamoyl]phenyl]prop-2-enamide?
The IUPAC name of N-[4-chloro-3-[(2-chlorophenyl)sulfamoyl]phenyl]prop-2-enamide (CID 167764718) is N-[4-chloro-3-[(2-chlorophenyl)sulfamoyl]phenyl]prop-2-enamide.
What is the SMILES notation for N-[4-chloro-3-[(2-chlorophenyl)sulfamoyl]phenyl]prop-2-enamide?
The canonical SMILES for N-[4-chloro-3-[(2-chlorophenyl)sulfamoyl]phenyl]prop-2-enamide is C=CC(=O)Nc1ccc(Cl)c(S(=O)(=O)Nc2ccccc2Cl)c1.
What is the InChIKey of N-[4-chloro-3-[(2-chlorophenyl)sulfamoyl]phenyl]prop-2-enamide?
The InChIKey is YHFJURZHBXJMNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2N2O3S/c1-2-15(20)18-10-7-8-12(17)14(9-10)23(21,22)19-13-6-4-3-5-11(13)16/h2-9,19H,1H2,(H,18,20).
What are the key properties of N-[4-chloro-3-[(2-chlorophenyl)sulfamoyl]phenyl]prop-2-enamide?
N-[4-chloro-3-[(2-chlorophenyl)sulfamoyl]phenyl]prop-2-enamide has a molecular weight of 371.25 g/mol, XLogP of 3.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-chloro-3-[(2-chlorophenyl)sulfamoyl]phenyl]prop-2-enamide is sourced from PubChem (CID 167764718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).