3-(methanesulfonamido)-4-methyl-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide

C19H19N3O3S2 — CID 55635987

IUPAC3-(methanesulfonamido)-4-methyl-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide
SMILESCc1ccc(C(=O)Nc2nc(C)c(-c3ccccc3)s2)cc1NS(C)(=O)=O
InChIInChI=1S/C19H19N3O3S2/c1-12-9-10-15(11-16(12)22-27(3,24)25)18(23)21-19-20-13(2)17(26-19)14-7-5-4-6-8-14/h4-11,22H,1-3H3,(H,20,21,23)
InChIKeyGZCPFLSNXPGQQF-UHFFFAOYSA-N
MW401.51 g/mol
LogP4.05
Rot. Bonds5

About 3-(methanesulfonamido)-4-methyl-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide

3-(methanesulfonamido)-4-methyl-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide (PubChem CID 55635987) has the molecular formula C19H19N3O3S2 and a molecular weight of 401.51 g/mol. Its IUPAC name is 3-(methanesulfonamido)-4-methyl-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3-(methanesulfonamido)-4-methyl-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide
PubChem CID55635987
Molecular FormulaC19H19N3O3S2
Molecular Weight401.51 g/mol
Exact Mass401.09
IUPAC Name3-(methanesulfonamido)-4-methyl-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide
SMILESCc1ccc(C(=O)Nc2nc(C)c(-c3ccccc3)s2)cc1NS(C)(=O)=O
InChIInChI=1S/C19H19N3O3S2/c1-12-9-10-15(11-16(12)22-27(3,24)25)18(23)21-19-20-13(2)17(26-19)14-7-5-4-6-8-14/h4-11,22H,1-3H3,(H,20,21,23)
InChIKeyGZCPFLSNXPGQQF-UHFFFAOYSA-N
XLogP4.05
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.51
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3,5-diacetamido-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide
CID 37200709
4-(methoxymethyl)-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide
CID 37201205
N-(3,4-dimethylphenyl)-3-(methanesulfonamido)-4-methylbenzamide
CID 41454864
N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)furan-3-carboxamide
CID 39189427
3-(methanesulfonamido)-4-methyl-N-[4-(3-phenyl-1H-1,2,4-triazol-5-yl)phenyl]benzamide
CID 166231057
3,4-dimethyl-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)benzamide
CID 868794
methyl 6-[(4-methyl-5-phenyl-1,3-thiazol-2-yl)carbamoyl]pyridine-3-carboxylate
CID 39189291
N-(5-chloro-2-methylphenyl)-3-(methanesulfonamido)-4-methylbenzamide
CID 41453282
3-(methanesulfonamido)-4-methyl-N-(3-methyl-4-pyridinyl)benzamide
CID 56803470
N-(2-benzyl-5-methylpyrazol-3-yl)-3-(methanesulfonamido)-4-methylbenzamide
CID 60571336
N-(4-fluorophenyl)-3-(methanesulfonamido)-4-methylbenzamide
CID 19062500
2-chloro-4,5-difluoro-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide
CID 39189888

Frequently Asked Questions

What is the IUPAC name of 3-(methanesulfonamido)-4-methyl-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 3-(methanesulfonamido)-4-methyl-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide (CID 55635987) is 3-(methanesulfonamido)-4-methyl-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 3-(methanesulfonamido)-4-methyl-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 3-(methanesulfonamido)-4-methyl-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide is Cc1ccc(C(=O)Nc2nc(C)c(-c3ccccc3)s2)cc1NS(C)(=O)=O.
What is the InChIKey of 3-(methanesulfonamido)-4-methyl-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is GZCPFLSNXPGQQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3S2/c1-12-9-10-15(11-16(12)22-27(3,24)25)18(23)21-19-20-13(2)17(26-19)14-7-5-4-6-8-14/h4-11,22H,1-3H3,(H,20,21,23).
What are the key properties of 3-(methanesulfonamido)-4-methyl-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide?
3-(methanesulfonamido)-4-methyl-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 401.51 g/mol, XLogP of 4.05, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methanesulfonamido)-4-methyl-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 55635987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).