2,5-dichloro-N-[4-[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]benzenesulfonamide

C22H16Cl2N2O4S — CID 10672207

IUPAC2,5-dichloro-N-[4-[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]benzenesulfonamide
SMILESCOc1ccccc1-c1cc(-c2ccc(NS(=O)(=O)c3cc(Cl)ccc3Cl)cc2)no1
InChIInChI=1S/C22H16Cl2N2O4S/c1-29-20-5-3-2-4-17(20)21-13-19(25-30-21)14-6-9-16(10-7-14)26-31(27,28)22-12-15(23)8-11-18(22)24/h2-13,26H,1H3
InChIKeyHNCMWWZLNSXUEQ-UHFFFAOYSA-N
MW475.35 g/mol
LogP6.12
Rot. Bonds6

About 2,5-dichloro-N-[4-[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]benzenesulfonamide

2,5-dichloro-N-[4-[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]benzenesulfonamide (PubChem CID 10672207) has the molecular formula C22H16Cl2N2O4S and a molecular weight of 475.35 g/mol. Its IUPAC name is 2,5-dichloro-N-[4-[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]benzenesulfonamide.

Molecular Properties

Compound Name2,5-dichloro-N-[4-[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]benzenesulfonamide
PubChem CID10672207
Molecular FormulaC22H16Cl2N2O4S
Molecular Weight475.35 g/mol
Exact Mass474.02
IUPAC Name2,5-dichloro-N-[4-[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]benzenesulfonamide
SMILESCOc1ccccc1-c1cc(-c2ccc(NS(=O)(=O)c3cc(Cl)ccc3Cl)cc2)no1
InChIInChI=1S/C22H16Cl2N2O4S/c1-29-20-5-3-2-4-17(20)21-13-19(25-30-21)14-6-9-16(10-7-14)26-31(27,28)22-12-15(23)8-11-18(22)24/h2-13,26H,1H3
InChIKeyHNCMWWZLNSXUEQ-UHFFFAOYSA-N
XLogP6.12
TPSA81.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500475.35
LogP ≤ 56.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2,5-dichloro-N-[4-[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]benzenesulfonamide 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

2,5-dichloro-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide
CID 2988024
3-(5-chloro-2-methoxyphenyl)-5-phenyl-1,2-oxazole
CID 150298354
5-[(2,5-dichlorophenyl)sulfonylamino]-2-methoxybenzenesulfonamide
CID 4826414
N-[3-[(2-chlorophenyl)sulfamoyl]-4-methylphenyl]-5-(2-methoxyphenyl)-1,2-oxazole-3-carboxamide
CID 46417426
N-[5-[(2,5-dichlorophenyl)sulfonylamino]-2-methoxyphenyl]acetamide
CID 31814804
2,5-dichloro-N-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl]benzenesulfonamide
CID 1480826
2,5-dichloro-N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzenesulfonamide
CID 41427562
5-chloro-2-methoxy-N-[3-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]benzenesulfonamide
CID 110418448
2,5-dichloro-N-(4-chloro-2,5-dimethoxyphenyl)benzenesulfonamide
CID 1005068
5-chloro-N-(3,4-dimethoxyphenyl)-2-methoxybenzenesulfonamide
CID 3706982
methyl 2-chloro-5-[(2,5-dichlorophenyl)sulfonylamino]benzoate
CID 40715475
5-chloro-2-methoxy-N-(6-methoxy-3-pyridinyl)benzenesulfonamide
CID 3476038

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-[4-[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]benzenesulfonamide?
The IUPAC name of 2,5-dichloro-N-[4-[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]benzenesulfonamide (CID 10672207) is 2,5-dichloro-N-[4-[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]benzenesulfonamide.
What is the SMILES notation for 2,5-dichloro-N-[4-[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]benzenesulfonamide?
The canonical SMILES for 2,5-dichloro-N-[4-[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]benzenesulfonamide is COc1ccccc1-c1cc(-c2ccc(NS(=O)(=O)c3cc(Cl)ccc3Cl)cc2)no1.
What is the InChIKey of 2,5-dichloro-N-[4-[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]benzenesulfonamide?
The InChIKey is HNCMWWZLNSXUEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16Cl2N2O4S/c1-29-20-5-3-2-4-17(20)21-13-19(25-30-21)14-6-9-16(10-7-14)26-31(27,28)22-12-15(23)8-11-18(22)24/h2-13,26H,1H3.
What are the key properties of 2,5-dichloro-N-[4-[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]benzenesulfonamide?
2,5-dichloro-N-[4-[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]benzenesulfonamide has a molecular weight of 475.35 g/mol, XLogP of 6.12, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-[4-[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]benzenesulfonamide is sourced from PubChem (CID 10672207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).