2-methyl-5-phenyl-N-(4-sulfamoylphenyl)-1,3-thiazole-4-carboxamide

C17H15N3O3S2 — CID 43854628

IUPAC2-methyl-5-phenyl-N-(4-sulfamoylphenyl)-1,3-thiazole-4-carboxamide
SMILESCc1nc(C(=O)Nc2ccc(S(N)(=O)=O)cc2)c(-c2ccccc2)s1
InChIInChI=1S/C17H15N3O3S2/c1-11-19-15(16(24-11)12-5-3-2-4-6-12)17(21)20-13-7-9-14(10-8-13)25(18,22)23/h2-10H,1H3,(H,20,21)(H2,18,22,23)
InChIKeyCZJSNCHDBYPRBQ-UHFFFAOYSA-N
MW373.46 g/mol
LogP3.02
Rot. Bonds4

About 2-methyl-5-phenyl-N-(4-sulfamoylphenyl)-1,3-thiazole-4-carboxamide

2-methyl-5-phenyl-N-(4-sulfamoylphenyl)-1,3-thiazole-4-carboxamide (PubChem CID 43854628) has the molecular formula C17H15N3O3S2 and a molecular weight of 373.46 g/mol. Its IUPAC name is 2-methyl-5-phenyl-N-(4-sulfamoylphenyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-methyl-5-phenyl-N-(4-sulfamoylphenyl)-1,3-thiazole-4-carboxamide
PubChem CID43854628
Molecular FormulaC17H15N3O3S2
Molecular Weight373.46 g/mol
Exact Mass373.06
IUPAC Name2-methyl-5-phenyl-N-(4-sulfamoylphenyl)-1,3-thiazole-4-carboxamide
SMILESCc1nc(C(=O)Nc2ccc(S(N)(=O)=O)cc2)c(-c2ccccc2)s1
InChIInChI=1S/C17H15N3O3S2/c1-11-19-15(16(24-11)12-5-3-2-4-6-12)17(21)20-13-7-9-14(10-8-13)25(18,22)23/h2-10H,1H3,(H,20,21)(H2,18,22,23)
InChIKeyCZJSNCHDBYPRBQ-UHFFFAOYSA-N
XLogP3.02
TPSA102.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-N-phenyl-2-(4-sulfamoylphenyl)-1,3-thiazole-5-carboxamide
CID 60620632
2-methyl-5-phenyl-N-(4-phenyl-1,2,5-oxadiazol-3-yl)-1,3-thiazole-4-carboxamide
CID 43854828
ethyl 2-[(2-methyl-5-phenyl-1,3-thiazole-4-carbonyl)amino]benzoate
CID 110651262
N-[(2S)-1-aminopropan-2-yl]-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide
CID 68727128
N-(5-chloro-2-methylphenyl)-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide
CID 43854702
2-[(5-methyl-4-phenyl-1H-imidazol-2-yl)sulfanyl]-N-(4-sulfamoylphenyl)acetamide
CID 6500458
N-cyclopentyl-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide
CID 110647439
5-methyl-N-(4-sulfamoylphenyl)thiophene-2-carboxamide
CID 36865757
4-oxo-N-(4-sulfamoylphenyl)-3H-phthalazine-1-carboxamide
CID 2103773
N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide
CID 43854818
N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide
CID 68727023
N-[(2S)-1-amino-4-methylpentan-2-yl]-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide
CID 68724998

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-phenyl-N-(4-sulfamoylphenyl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-methyl-5-phenyl-N-(4-sulfamoylphenyl)-1,3-thiazole-4-carboxamide (CID 43854628) is 2-methyl-5-phenyl-N-(4-sulfamoylphenyl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-methyl-5-phenyl-N-(4-sulfamoylphenyl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-methyl-5-phenyl-N-(4-sulfamoylphenyl)-1,3-thiazole-4-carboxamide is Cc1nc(C(=O)Nc2ccc(S(N)(=O)=O)cc2)c(-c2ccccc2)s1.
What is the InChIKey of 2-methyl-5-phenyl-N-(4-sulfamoylphenyl)-1,3-thiazole-4-carboxamide?
The InChIKey is CZJSNCHDBYPRBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O3S2/c1-11-19-15(16(24-11)12-5-3-2-4-6-12)17(21)20-13-7-9-14(10-8-13)25(18,22)23/h2-10H,1H3,(H,20,21)(H2,18,22,23).
What are the key properties of 2-methyl-5-phenyl-N-(4-sulfamoylphenyl)-1,3-thiazole-4-carboxamide?
2-methyl-5-phenyl-N-(4-sulfamoylphenyl)-1,3-thiazole-4-carboxamide has a molecular weight of 373.46 g/mol, XLogP of 3.02, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-phenyl-N-(4-sulfamoylphenyl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 43854628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).