2,4-dichloro-5-[ethyl(phenyl)sulfamoyl]-N-methyl-N-phenylbenzamide

C22H20Cl2N2O3S — CID 34495212

IUPAC2,4-dichloro-5-[ethyl(phenyl)sulfamoyl]-N-methyl-N-phenylbenzamide
SMILESCCN(c1ccccc1)S(=O)(=O)c1cc(C(=O)N(C)c2ccccc2)c(Cl)cc1Cl
InChIInChI=1S/C22H20Cl2N2O3S/c1-3-26(17-12-8-5-9-13-17)30(28,29)21-14-18(19(23)15-20(21)24)22(27)25(2)16-10-6-4-7-11-16/h4-15H,3H2,1-2H3
InChIKeyPRSMFICIAUXLTE-UHFFFAOYSA-N
MW463.39 g/mol
LogP5.49
Rot. Bonds6

About 2,4-dichloro-5-[ethyl(phenyl)sulfamoyl]-N-methyl-N-phenylbenzamide

2,4-dichloro-5-[ethyl(phenyl)sulfamoyl]-N-methyl-N-phenylbenzamide (PubChem CID 34495212) has the molecular formula C22H20Cl2N2O3S and a molecular weight of 463.39 g/mol. Its IUPAC name is 2,4-dichloro-5-[ethyl(phenyl)sulfamoyl]-N-methyl-N-phenylbenzamide.

Molecular Properties

Compound Name2,4-dichloro-5-[ethyl(phenyl)sulfamoyl]-N-methyl-N-phenylbenzamide
PubChem CID34495212
Molecular FormulaC22H20Cl2N2O3S
Molecular Weight463.39 g/mol
Exact Mass462.06
IUPAC Name2,4-dichloro-5-[ethyl(phenyl)sulfamoyl]-N-methyl-N-phenylbenzamide
SMILESCCN(c1ccccc1)S(=O)(=O)c1cc(C(=O)N(C)c2ccccc2)c(Cl)cc1Cl
InChIInChI=1S/C22H20Cl2N2O3S/c1-3-26(17-12-8-5-9-13-17)30(28,29)21-14-18(19(23)15-20(21)24)22(27)25(2)16-10-6-4-7-11-16/h4-15H,3H2,1-2H3
InChIKeyPRSMFICIAUXLTE-UHFFFAOYSA-N
XLogP5.49
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500463.39
LogP ≤ 55.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-dichloro-5-[ethyl(phenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide
CID 26578423
2-[ethyl(phenyl)sulfamoyl]benzoic acid
CID 18615557
2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-(2-methylpropyl)benzamide
CID 7959591
[2-[4-chloro-3-[ethyl(phenyl)sulfamoyl]anilino]-2-oxoethyl]-dimethylazanium
CID 7870484
3,4-dichloro-N-ethyl-N-phenylbenzenesulfonamide
CID 2234505
2-chloro-N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-5-[ethyl(phenyl)sulfamoyl]benzamide
CID 55368520
N-butyl-2,4-dichloro-5-methyl-N-phenylbenzenesulfonamide
CID 3856862
2-chloro-N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]pyridine-3-carboxamide
CID 52893457
N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]-2,5-difluorobenzamide
CID 43030093
4-bromo-2,6-dichloro-N-ethyl-N-phenylbenzenesulfonamide
CID 60639715
N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]-2-(1,2,4-triazol-1-yl)propanamide
CID 112816128
3-acetamido-N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]benzamide
CID 42992579

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-5-[ethyl(phenyl)sulfamoyl]-N-methyl-N-phenylbenzamide?
The IUPAC name of 2,4-dichloro-5-[ethyl(phenyl)sulfamoyl]-N-methyl-N-phenylbenzamide (CID 34495212) is 2,4-dichloro-5-[ethyl(phenyl)sulfamoyl]-N-methyl-N-phenylbenzamide.
What is the SMILES notation for 2,4-dichloro-5-[ethyl(phenyl)sulfamoyl]-N-methyl-N-phenylbenzamide?
The canonical SMILES for 2,4-dichloro-5-[ethyl(phenyl)sulfamoyl]-N-methyl-N-phenylbenzamide is CCN(c1ccccc1)S(=O)(=O)c1cc(C(=O)N(C)c2ccccc2)c(Cl)cc1Cl.
What is the InChIKey of 2,4-dichloro-5-[ethyl(phenyl)sulfamoyl]-N-methyl-N-phenylbenzamide?
The InChIKey is PRSMFICIAUXLTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20Cl2N2O3S/c1-3-26(17-12-8-5-9-13-17)30(28,29)21-14-18(19(23)15-20(21)24)22(27)25(2)16-10-6-4-7-11-16/h4-15H,3H2,1-2H3.
What are the key properties of 2,4-dichloro-5-[ethyl(phenyl)sulfamoyl]-N-methyl-N-phenylbenzamide?
2,4-dichloro-5-[ethyl(phenyl)sulfamoyl]-N-methyl-N-phenylbenzamide has a molecular weight of 463.39 g/mol, XLogP of 5.49, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-5-[ethyl(phenyl)sulfamoyl]-N-methyl-N-phenylbenzamide is sourced from PubChem (CID 34495212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).