3-[(4-chlorophenyl)sulfonylamino]-N-[1-(3-methoxyphenyl)pyrazol-4-yl]benzamide

C23H19ClN4O4S — CID 155555935

IUPAC3-[(4-chlorophenyl)sulfonylamino]-N-[1-(3-methoxyphenyl)pyrazol-4-yl]benzamide
SMILESCOc1cccc(-n2cc(NC(=O)c3cccc(NS(=O)(=O)c4ccc(Cl)cc4)c3)cn2)c1
InChIInChI=1S/C23H19ClN4O4S/c1-32-21-7-3-6-20(13-21)28-15-19(14-25-28)26-23(29)16-4-2-5-18(12-16)27-33(30,31)22-10-8-17(24)9-11-22/h2-15,27H,1H3,(H,26,29)
InChIKeyPAMONGFFBXYNAH-UHFFFAOYSA-N
MW482.95 g/mol
LogP4.59
Rot. Bonds7

About 3-[(4-chlorophenyl)sulfonylamino]-N-[1-(3-methoxyphenyl)pyrazol-4-yl]benzamide

3-[(4-chlorophenyl)sulfonylamino]-N-[1-(3-methoxyphenyl)pyrazol-4-yl]benzamide (PubChem CID 155555935) has the molecular formula C23H19ClN4O4S and a molecular weight of 482.95 g/mol. Its IUPAC name is 3-[(4-chlorophenyl)sulfonylamino]-N-[1-(3-methoxyphenyl)pyrazol-4-yl]benzamide.

Molecular Properties

Compound Name3-[(4-chlorophenyl)sulfonylamino]-N-[1-(3-methoxyphenyl)pyrazol-4-yl]benzamide
PubChem CID155555935
Molecular FormulaC23H19ClN4O4S
Molecular Weight482.95 g/mol
Exact Mass482.08
IUPAC Name3-[(4-chlorophenyl)sulfonylamino]-N-[1-(3-methoxyphenyl)pyrazol-4-yl]benzamide
SMILESCOc1cccc(-n2cc(NC(=O)c3cccc(NS(=O)(=O)c4ccc(Cl)cc4)c3)cn2)c1
InChIInChI=1S/C23H19ClN4O4S/c1-32-21-7-3-6-20(13-21)28-15-19(14-25-28)26-23(29)16-4-2-5-18(12-16)27-33(30,31)22-10-8-17(24)9-11-22/h2-15,27H,1H3,(H,26,29)
InChIKeyPAMONGFFBXYNAH-UHFFFAOYSA-N
XLogP4.59
TPSA102.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500482.95
LogP ≤ 54.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-[4-(benzenesulfonamido)pyrazol-1-yl]-N-(3,4,5-trimethoxyphenyl)benzamide
CID 117075073
3-(benzenesulfonamido)-N-(3-methoxyphenyl)benzamide
CID 7541945
4-chloro-N-(3-methoxyphenyl)benzenesulfonamide
CID 819759
N-[4-(4-chloropyrazol-1-yl)phenyl]-3-methoxybenzamide
CID 35761483
3-[4-[(4-chlorophenyl)carbamoylamino]pyrazol-1-yl]-N-(3,4,5-trimethoxyphenyl)benzamide
CID 70702009
3-[(4-methoxyphenyl)sulfonylamino]-N-[4-[4-[[3-[(4-methoxyphenyl)sulfonylamino]benzoyl]amino]phenyl]phenyl]benzamide
CID 121043305
N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]-1-phenylpyrazole-4-carboxamide
CID 29202603
N-[1-(3-chlorophenyl)pyrazol-4-yl]benzamide
CID 67287365
4-chloro-N-[2-fluoro-4-[(3-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 18892649
N-[3-[(4-chlorophenyl)sulfonylamino]phenyl]benzamide
CID 1216913
4-[(4-methylphenyl)sulfamoyl]-N-(1-phenylpyrazol-4-yl)benzamide
CID 47081142
N-(3-methoxyphenyl)-4-(phenylsulfamoyl)benzamide
CID 27167578

Frequently Asked Questions

What is the IUPAC name of 3-[(4-chlorophenyl)sulfonylamino]-N-[1-(3-methoxyphenyl)pyrazol-4-yl]benzamide?
The IUPAC name of 3-[(4-chlorophenyl)sulfonylamino]-N-[1-(3-methoxyphenyl)pyrazol-4-yl]benzamide (CID 155555935) is 3-[(4-chlorophenyl)sulfonylamino]-N-[1-(3-methoxyphenyl)pyrazol-4-yl]benzamide.
What is the SMILES notation for 3-[(4-chlorophenyl)sulfonylamino]-N-[1-(3-methoxyphenyl)pyrazol-4-yl]benzamide?
The canonical SMILES for 3-[(4-chlorophenyl)sulfonylamino]-N-[1-(3-methoxyphenyl)pyrazol-4-yl]benzamide is COc1cccc(-n2cc(NC(=O)c3cccc(NS(=O)(=O)c4ccc(Cl)cc4)c3)cn2)c1.
What is the InChIKey of 3-[(4-chlorophenyl)sulfonylamino]-N-[1-(3-methoxyphenyl)pyrazol-4-yl]benzamide?
The InChIKey is PAMONGFFBXYNAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19ClN4O4S/c1-32-21-7-3-6-20(13-21)28-15-19(14-25-28)26-23(29)16-4-2-5-18(12-16)27-33(30,31)22-10-8-17(24)9-11-22/h2-15,27H,1H3,(H,26,29).
What are the key properties of 3-[(4-chlorophenyl)sulfonylamino]-N-[1-(3-methoxyphenyl)pyrazol-4-yl]benzamide?
3-[(4-chlorophenyl)sulfonylamino]-N-[1-(3-methoxyphenyl)pyrazol-4-yl]benzamide has a molecular weight of 482.95 g/mol, XLogP of 4.59, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-chlorophenyl)sulfonylamino]-N-[1-(3-methoxyphenyl)pyrazol-4-yl]benzamide is sourced from PubChem (CID 155555935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).