2,4-dichloro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide

C15H14Cl2N2O4S — CID 37258917

IUPAC2,4-dichloro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide
SMILESCOc1cc(NC(=O)c2ccc(Cl)cc2Cl)ccc1NS(C)(=O)=O
InChIInChI=1S/C15H14Cl2N2O4S/c1-23-14-8-10(4-6-13(14)19-24(2,21)22)18-15(20)11-5-3-9(16)7-12(11)17/h3-8,19H,1-2H3,(H,18,20)
InChIKeyHYYPJBMKAZDPSW-UHFFFAOYSA-N
MW389.26 g/mol
LogP3.63
Rot. Bonds5

About 2,4-dichloro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide

2,4-dichloro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide (PubChem CID 37258917) has the molecular formula C15H14Cl2N2O4S and a molecular weight of 389.26 g/mol. Its IUPAC name is 2,4-dichloro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide.

Molecular Properties

Compound Name2,4-dichloro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide
PubChem CID37258917
Molecular FormulaC15H14Cl2N2O4S
Molecular Weight389.26 g/mol
Exact Mass388.01
IUPAC Name2,4-dichloro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide
SMILESCOc1cc(NC(=O)c2ccc(Cl)cc2Cl)ccc1NS(C)(=O)=O
InChIInChI=1S/C15H14Cl2N2O4S/c1-23-14-8-10(4-6-13(14)19-24(2,21)22)18-15(20)11-5-3-9(16)7-12(11)17/h3-8,19H,1-2H3,(H,18,20)
InChIKeyHYYPJBMKAZDPSW-UHFFFAOYSA-N
XLogP3.63
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.26
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-4-fluoro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide
CID 37259546
2-(2,4-dichlorophenyl)-N-[4-(methanesulfonamido)-3-methoxyphenyl]acetamide
CID 37259252
4-bromo-2-fluoro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide
CID 37260856
2-chloro-N-(4-chloro-2-methylphenyl)-4-(methanesulfonamido)benzamide
CID 28580400
2,4-dichloro-N-[2-(methanesulfonamido)phenyl]benzamide
CID 35368130
2-chloro-N-[3-(methanesulfonamido)-4-methoxyphenyl]-4-nitrobenzamide
CID 39975932
5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide
CID 17111377
5-chloro-2-fluoro-N-[4-fluoro-3-(methanesulfonamido)phenyl]benzamide
CID 25487071
5-chloro-N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide
CID 107623034
2-bromo-2,2-difluoro-N-[4-(methanesulfonamido)-3-methoxyphenyl]acetamide
CID 51132083
2,5-dichloro-N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]benzamide
CID 17115543
2,4-dichloro-N-[4-[(2,4-dimethoxyphenyl)sulfamoyl]-2-fluorophenyl]benzamide
CID 18893144

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide?
The IUPAC name of 2,4-dichloro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide (CID 37258917) is 2,4-dichloro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide.
What is the SMILES notation for 2,4-dichloro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide?
The canonical SMILES for 2,4-dichloro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide is COc1cc(NC(=O)c2ccc(Cl)cc2Cl)ccc1NS(C)(=O)=O.
What is the InChIKey of 2,4-dichloro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide?
The InChIKey is HYYPJBMKAZDPSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O4S/c1-23-14-8-10(4-6-13(14)19-24(2,21)22)18-15(20)11-5-3-9(16)7-12(11)17/h3-8,19H,1-2H3,(H,18,20).
What are the key properties of 2,4-dichloro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide?
2,4-dichloro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide has a molecular weight of 389.26 g/mol, XLogP of 3.63, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide is sourced from PubChem (CID 37258917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).