4-chloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide

C17H17ClN2O4S — CID 7759044

IUPAC4-chloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide
SMILESO=C(Nc1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(Cl)cc1
InChIInChI=1S/C17H17ClN2O4S/c18-14-6-4-13(5-7-14)17(21)19-15-2-1-3-16(12-15)25(22,23)20-8-10-24-11-9-20/h1-7,12H,8-11H2,(H,19,21)
InChIKeyZLUIFTRDCCGQRV-UHFFFAOYSA-N
MW380.85 g/mol
LogP2.61
Rot. Bonds4

About 4-chloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide

4-chloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide (PubChem CID 7759044) has the molecular formula C17H17ClN2O4S and a molecular weight of 380.85 g/mol. Its IUPAC name is 4-chloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide.

Molecular Properties

Compound Name4-chloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide
PubChem CID7759044
Molecular FormulaC17H17ClN2O4S
Molecular Weight380.85 g/mol
Exact Mass380.06
IUPAC Name4-chloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide
SMILESO=C(Nc1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(Cl)cc1
InChIInChI=1S/C17H17ClN2O4S/c18-14-6-4-13(5-7-14)17(21)19-15-2-1-3-16(12-15)25(22,23)20-8-10-24-11-9-20/h1-7,12H,8-11H2,(H,19,21)
InChIKeyZLUIFTRDCCGQRV-UHFFFAOYSA-N
XLogP2.61
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.85
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-dichloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide
CID 4800329
N-(3-morpholin-4-ylsulfonylphenyl)-4-propan-2-ylbenzamide
CID 7759072
2-chloro-4,5-difluoro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide
CID 4803040
3,5-dimethyl-N-(3-morpholin-4-ylsulfonylphenyl)benzamide
CID 4799420
N-(3-morpholin-4-ylsulfonylphenyl)-4-propan-2-yloxybenzamide
CID 7759035
3-iodo-N-(3-morpholin-4-ylsulfonylphenyl)benzamide
CID 42991896
4-chloro-3-(dimethylsulfamoyl)-N-(3-morpholin-4-ylsulfonylphenyl)benzamide
CID 26590050
2-chloro-N-(3-morpholin-4-ylsulfonylphenyl)cyclohexene-1-carboxamide
CID 17452404
2-(4-chlorophenyl)sulfanyl-N-(3-morpholin-4-ylsulfonylphenyl)acetamide
CID 3424032
2,4-dichloro-5-morpholin-4-ylsulfonyl-N-(3-morpholin-4-ylsulfonylphenyl)benzamide
CID 3368356
1-(4-chlorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide
CID 17477829
N-(4-acetylphenyl)-3-morpholin-4-ylsulfonylbenzamide
CID 1081959

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide?
The IUPAC name of 4-chloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide (CID 7759044) is 4-chloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide.
What is the SMILES notation for 4-chloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide?
The canonical SMILES for 4-chloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide is O=C(Nc1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide?
The InChIKey is ZLUIFTRDCCGQRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O4S/c18-14-6-4-13(5-7-14)17(21)19-15-2-1-3-16(12-15)25(22,23)20-8-10-24-11-9-20/h1-7,12H,8-11H2,(H,19,21).
What are the key properties of 4-chloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide?
4-chloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide has a molecular weight of 380.85 g/mol, XLogP of 2.61, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide is sourced from PubChem (CID 7759044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).