4-[3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl]benzamide

C19H20N4O3S — CID 141199028

IUPAC4-[3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl]benzamide
SMILESCc1nn(C)c(C)c1S(=O)(=O)Nc1cccc(-c2ccc(C(N)=O)cc2)c1
InChIInChI=1S/C19H20N4O3S/c1-12-18(13(2)23(3)21-12)27(25,26)22-17-6-4-5-16(11-17)14-7-9-15(10-8-14)19(20)24/h4-11,22H,1-3H3,(H2,20,24)
InChIKeyDTVKOIZQTRJIBD-UHFFFAOYSA-N
MW384.46 g/mol
LogP2.60
Rot. Bonds5

About 4-[3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl]benzamide

4-[3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl]benzamide (PubChem CID 141199028) has the molecular formula C19H20N4O3S and a molecular weight of 384.46 g/mol. Its IUPAC name is 4-[3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl]benzamide.

Molecular Properties

Compound Name4-[3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl]benzamide
PubChem CID141199028
Molecular FormulaC19H20N4O3S
Molecular Weight384.46 g/mol
Exact Mass384.13
IUPAC Name4-[3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl]benzamide
SMILESCc1nn(C)c(C)c1S(=O)(=O)Nc1cccc(-c2ccc(C(N)=O)cc2)c1
InChIInChI=1S/C19H20N4O3S/c1-12-18(13(2)23(3)21-12)27(25,26)22-17-6-4-5-16(11-17)14-7-9-15(10-8-14)19(20)24/h4-11,22H,1-3H3,(H2,20,24)
InChIKeyDTVKOIZQTRJIBD-UHFFFAOYSA-N
XLogP2.60
TPSA107.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.46
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-[3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[(3-amino-1,5-dimethylpyrazol-4-yl)sulfonylamino]benzamide
CID 105358140
N-(4-acetylphenyl)-1,3,5-trimethylpyrazole-4-sulfonamide
CID 8822254
N-(3-formylphenyl)-1,3,5-trimethylpyrazole-4-sulfonamide
CID 106913044
N-(3,5-dimethylphenyl)-1,3,5-trimethylpyrazole-4-sulfonamide
CID 3682880
1,3,5-trimethyl-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]pyrazole-4-sulfonamide
CID 122285014
N-[4-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl]acetamide
CID 22774832
N-(2,6-dimethylphenyl)-1,3,5-trimethylpyrazole-4-sulfonamide
CID 8822901
N-[4-(aminomethyl)phenyl]-1,3,5-trimethylpyrazole-4-sulfonamide
CID 62061884
N-(5-bromonaphthalen-2-yl)-1,3,5-trimethylpyrazole-4-sulfonamide
CID 146022108
N-(3-amino-5-fluorophenyl)-1,3,5-trimethylpyrazole-4-sulfonamide
CID 107334292
4-[[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]sulfamoyl]benzamide
CID 46547591
N-(3-bromo-4-fluorophenyl)-1,3,5-trimethylpyrazole-4-sulfonamide
CID 104779597

Frequently Asked Questions

What is the IUPAC name of 4-[3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl]benzamide?
The IUPAC name of 4-[3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl]benzamide (CID 141199028) is 4-[3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl]benzamide.
What is the SMILES notation for 4-[3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl]benzamide?
The canonical SMILES for 4-[3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl]benzamide is Cc1nn(C)c(C)c1S(=O)(=O)Nc1cccc(-c2ccc(C(N)=O)cc2)c1.
What is the InChIKey of 4-[3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl]benzamide?
The InChIKey is DTVKOIZQTRJIBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O3S/c1-12-18(13(2)23(3)21-12)27(25,26)22-17-6-4-5-16(11-17)14-7-9-15(10-8-14)19(20)24/h4-11,22H,1-3H3,(H2,20,24).
What are the key properties of 4-[3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl]benzamide?
4-[3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl]benzamide has a molecular weight of 384.46 g/mol, XLogP of 2.60, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl]benzamide is sourced from PubChem (CID 141199028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).