N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide

C24H24ClN3O4S — CID 92646826

IUPACN-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ccccc2Cl)cc1)c1cccc(CN2CCOCC2)c1
InChIInChI=1S/C24H24ClN3O4S/c25-22-6-1-2-7-23(22)27-33(30,31)21-10-8-20(9-11-21)26-24(29)19-5-3-4-18(16-19)17-28-12-14-32-15-13-28/h1-11,16,27H,12-15,17H2,(H,26,29)
InChIKeyCXUNBRUYIFXAJV-UHFFFAOYSA-N
MW485.99 g/mol
LogP4.23
Rot. Bonds7

About N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide

N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide (PubChem CID 92646826) has the molecular formula C24H24ClN3O4S and a molecular weight of 485.99 g/mol. Its IUPAC name is N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide.

Molecular Properties

Compound NameN-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide
PubChem CID92646826
Molecular FormulaC24H24ClN3O4S
Molecular Weight485.99 g/mol
Exact Mass485.12
IUPAC NameN-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ccccc2Cl)cc1)c1cccc(CN2CCOCC2)c1
InChIInChI=1S/C24H24ClN3O4S/c25-22-6-1-2-7-23(22)27-33(30,31)21-10-8-20(9-11-21)26-24(29)19-5-3-4-18(16-19)17-28-12-14-32-15-13-28/h1-11,16,27H,12-15,17H2,(H,26,29)
InChIKeyCXUNBRUYIFXAJV-UHFFFAOYSA-N
XLogP4.23
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500485.99
LogP ≤ 54.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide
CID 28579825
3-(morpholin-4-ylmethyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 28631315
N-[4-[(2,5-dimethylphenyl)sulfamoyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide
CID 92683706
N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-4-morpholin-4-yl-3,5-dinitrobenzamide
CID 25042551
3-(benzenesulfonamido)-N-[4-(2-morpholin-4-ylethyl)phenyl]benzamide
CID 55976882
N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(morpholin-4-ylmethyl)benzamide
CID 126320858
N-(3,4-dimethylphenyl)-3-(morpholin-4-ylmethyl)benzamide
CID 46769268
3-[(2-chlorophenyl)sulfamoyl]-N-(4-methylphenyl)benzamide
CID 2687813
N-[4-(azepan-1-ylsulfonyl)phenyl]-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide
CID 43925182
N-[[3-(morpholin-4-ylmethyl)phenyl]methyl]-4-(phenylsulfamoyl)benzamide
CID 55814511
N-[4-(azepan-1-ylsulfonyl)phenyl]-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide
CID 43925181
3-(morpholin-4-ylmethyl)-N-[2-(trifluoromethyl)phenyl]benzamide
CID 46778635

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide?
The IUPAC name of N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide (CID 92646826) is N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide.
What is the SMILES notation for N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide?
The canonical SMILES for N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide is O=C(Nc1ccc(S(=O)(=O)Nc2ccccc2Cl)cc1)c1cccc(CN2CCOCC2)c1.
What is the InChIKey of N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide?
The InChIKey is CXUNBRUYIFXAJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24ClN3O4S/c25-22-6-1-2-7-23(22)27-33(30,31)21-10-8-20(9-11-21)26-24(29)19-5-3-4-18(16-19)17-28-12-14-32-15-13-28/h1-11,16,27H,12-15,17H2,(H,26,29).
What are the key properties of N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide?
N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide has a molecular weight of 485.99 g/mol, XLogP of 4.23, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide is sourced from PubChem (CID 92646826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).