N-(3-acetamido-4-methoxyphenyl)-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide

C24H25N3O5S — CID 24666750

IUPACN-(3-acetamido-4-methoxyphenyl)-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide
SMILESCOc1ccc(NC(=O)c2ccc(S(=O)(=O)Nc3ccc(C)c(C)c3)cc2)cc1NC(C)=O
InChIInChI=1S/C24H25N3O5S/c1-15-5-8-20(13-16(15)2)27-33(30,31)21-10-6-18(7-11-21)24(29)26-19-9-12-23(32-4)22(14-19)25-17(3)28/h5-14,27H,1-4H3,(H,25,28)(H,26,29)
InChIKeyPRWBVCKTTCKFJH-UHFFFAOYSA-N
MW467.55 g/mol
LogP4.32
Rot. Bonds7

About N-(3-acetamido-4-methoxyphenyl)-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide

N-(3-acetamido-4-methoxyphenyl)-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide (PubChem CID 24666750) has the molecular formula C24H25N3O5S and a molecular weight of 467.55 g/mol. Its IUPAC name is N-(3-acetamido-4-methoxyphenyl)-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(3-acetamido-4-methoxyphenyl)-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide
PubChem CID24666750
Molecular FormulaC24H25N3O5S
Molecular Weight467.55 g/mol
Exact Mass467.15
IUPAC NameN-(3-acetamido-4-methoxyphenyl)-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide
SMILESCOc1ccc(NC(=O)c2ccc(S(=O)(=O)Nc3ccc(C)c(C)c3)cc2)cc1NC(C)=O
InChIInChI=1S/C24H25N3O5S/c1-15-5-8-20(13-16(15)2)27-33(30,31)21-10-6-18(7-11-21)24(29)26-19-9-12-23(32-4)22(14-19)25-17(3)28/h5-14,27H,1-4H3,(H,25,28)(H,26,29)
InChIKeyPRWBVCKTTCKFJH-UHFFFAOYSA-N
XLogP4.32
TPSA113.60 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.55
LogP ≤ 54.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-acetamido-4-methoxyphenyl)-4-(phenylsulfamoyl)benzamide
CID 24666755
N-(3,4-dimethylphenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26593901
methyl 3-[[4-[(3,4-dimethylphenyl)sulfamoyl]benzoyl]amino]benzoate
CID 26886837
N-[2-methoxy-5-[[4-methyl-3-(trifluoromethyl)phenyl]sulfamoyl]phenyl]acetamide
CID 24580787
3-[(3,4-dimethylphenyl)sulfamoyl]-N-[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]-4-methylbenzamide
CID 126414918
4-[(3,4-dimethylphenyl)sulfamoyl]-N-(3-fluorophenyl)benzamide
CID 26579304
4-[(4-fluorophenyl)sulfamoyl]-N-(2-methoxy-5-methylphenyl)benzamide
CID 26709820
N-(3,4-dimethoxyphenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26695232
N-(5-chloro-2-methoxyphenyl)-3-[(3,4-dimethylphenyl)sulfamoyl]-4-methylbenzamide
CID 126415005
5-bromo-N-[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]-2-methoxybenzamide
CID 17094210
3,4-dichloro-N-[4-methoxy-3-[(4-methylphenyl)sulfonylamino]phenyl]benzamide
CID 18626096
N-[5-[(3,4-difluorophenyl)sulfamoyl]-2-methoxyphenyl]acetamide
CID 7514306

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamido-4-methoxyphenyl)-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide?
The IUPAC name of N-(3-acetamido-4-methoxyphenyl)-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide (CID 24666750) is N-(3-acetamido-4-methoxyphenyl)-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-(3-acetamido-4-methoxyphenyl)-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide?
The canonical SMILES for N-(3-acetamido-4-methoxyphenyl)-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide is COc1ccc(NC(=O)c2ccc(S(=O)(=O)Nc3ccc(C)c(C)c3)cc2)cc1NC(C)=O.
What is the InChIKey of N-(3-acetamido-4-methoxyphenyl)-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide?
The InChIKey is PRWBVCKTTCKFJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O5S/c1-15-5-8-20(13-16(15)2)27-33(30,31)21-10-6-18(7-11-21)24(29)26-19-9-12-23(32-4)22(14-19)25-17(3)28/h5-14,27H,1-4H3,(H,25,28)(H,26,29).
What are the key properties of N-(3-acetamido-4-methoxyphenyl)-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide?
N-(3-acetamido-4-methoxyphenyl)-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide has a molecular weight of 467.55 g/mol, XLogP of 4.32, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamido-4-methoxyphenyl)-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 24666750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).