2-methyl-5-morpholin-4-ylsulfonyl-N-(4-phenylphenyl)benzamide

C24H24N2O4S — CID 2676901

IUPAC2-methyl-5-morpholin-4-ylsulfonyl-N-(4-phenylphenyl)benzamide
SMILESCc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C24H24N2O4S/c1-18-7-12-22(31(28,29)26-13-15-30-16-14-26)17-23(18)24(27)25-21-10-8-20(9-11-21)19-5-3-2-4-6-19/h2-12,17H,13-16H2,1H3,(H,25,27)
InChIKeyHTZNKOSMXLKOKR-UHFFFAOYSA-N
MW436.53 g/mol
LogP3.94
Rot. Bonds5

About 2-methyl-5-morpholin-4-ylsulfonyl-N-(4-phenylphenyl)benzamide

2-methyl-5-morpholin-4-ylsulfonyl-N-(4-phenylphenyl)benzamide (PubChem CID 2676901) has the molecular formula C24H24N2O4S and a molecular weight of 436.53 g/mol. Its IUPAC name is 2-methyl-5-morpholin-4-ylsulfonyl-N-(4-phenylphenyl)benzamide.

Molecular Properties

Compound Name2-methyl-5-morpholin-4-ylsulfonyl-N-(4-phenylphenyl)benzamide
PubChem CID2676901
Molecular FormulaC24H24N2O4S
Molecular Weight436.53 g/mol
Exact Mass436.15
IUPAC Name2-methyl-5-morpholin-4-ylsulfonyl-N-(4-phenylphenyl)benzamide
SMILESCc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C24H24N2O4S/c1-18-7-12-22(31(28,29)26-13-15-30-16-14-26)17-23(18)24(27)25-21-10-8-20(9-11-21)19-5-3-2-4-6-19/h2-12,17H,13-16H2,1H3,(H,25,27)
InChIKeyHTZNKOSMXLKOKR-UHFFFAOYSA-N
XLogP3.94
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.53
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-5-morpholin-4-ylsulfonyl-N-pyridin-4-ylbenzamide
CID 25162643
2-methyl-5-morpholin-4-ylsulfonyl-N-(4-nitrophenyl)benzamide
CID 9395287
3-[(2-methyl-5-morpholin-4-ylsulfonylbenzoyl)amino]benzoic acid
CID 23761201
N-(2-acetylphenyl)-2-methyl-5-morpholin-4-ylsulfonylbenzamide
CID 8749628
2-methyl-N-(4-morpholin-4-ylphenyl)-5-piperidin-1-ylsulfonylbenzamide
CID 2111262
N-[4-[(3-chloro-2-methylphenyl)sulfamoyl]phenyl]-2-methyl-5-morpholin-4-ylsulfonylbenzamide
CID 43882527
2-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-5-morpholin-4-ylsulfonylbenzamide
CID 2331045
N-[4-(3-amino-3-oxopropoxy)phenyl]-2-methyl-5-morpholin-4-ylsulfonylbenzamide
CID 55962001
2-methyl-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-5-morpholin-4-ylsulfonylbenzamide
CID 55498032
2-chloro-5-morpholin-4-ylsulfonyl-N-(5-phenyl-2-pyridinyl)benzamide
CID 55978562
2-methyl-3-[(2-methyl-5-morpholin-4-ylsulfonylbenzoyl)amino]benzamide
CID 34584461
2-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-6-phenylpyridine-3-carboxamide
CID 24529088

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-morpholin-4-ylsulfonyl-N-(4-phenylphenyl)benzamide?
The IUPAC name of 2-methyl-5-morpholin-4-ylsulfonyl-N-(4-phenylphenyl)benzamide (CID 2676901) is 2-methyl-5-morpholin-4-ylsulfonyl-N-(4-phenylphenyl)benzamide.
What is the SMILES notation for 2-methyl-5-morpholin-4-ylsulfonyl-N-(4-phenylphenyl)benzamide?
The canonical SMILES for 2-methyl-5-morpholin-4-ylsulfonyl-N-(4-phenylphenyl)benzamide is Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)Nc1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2-methyl-5-morpholin-4-ylsulfonyl-N-(4-phenylphenyl)benzamide?
The InChIKey is HTZNKOSMXLKOKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O4S/c1-18-7-12-22(31(28,29)26-13-15-30-16-14-26)17-23(18)24(27)25-21-10-8-20(9-11-21)19-5-3-2-4-6-19/h2-12,17H,13-16H2,1H3,(H,25,27).
What are the key properties of 2-methyl-5-morpholin-4-ylsulfonyl-N-(4-phenylphenyl)benzamide?
2-methyl-5-morpholin-4-ylsulfonyl-N-(4-phenylphenyl)benzamide has a molecular weight of 436.53 g/mol, XLogP of 3.94, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-morpholin-4-ylsulfonyl-N-(4-phenylphenyl)benzamide is sourced from PubChem (CID 2676901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).