N-(4-methyl-3-sulfamoylphenyl)thiadiazole-5-carboxamide

C10H10N4O3S2 — CID 47332366

IUPACN-(4-methyl-3-sulfamoylphenyl)thiadiazole-5-carboxamide
SMILESCc1ccc(NC(=O)c2cnns2)cc1S(N)(=O)=O
InChIInChI=1S/C10H10N4O3S2/c1-6-2-3-7(4-9(6)19(11,16)17)13-10(15)8-5-12-14-18-8/h2-5H,1H3,(H,13,15)(H2,11,16,17)
InChIKeyKQYBAFSLWMEJFZ-UHFFFAOYSA-N
MW298.35 g/mol
LogP0.75
Rot. Bonds3

About N-(4-methyl-3-sulfamoylphenyl)thiadiazole-5-carboxamide

N-(4-methyl-3-sulfamoylphenyl)thiadiazole-5-carboxamide (PubChem CID 47332366) has the molecular formula C10H10N4O3S2 and a molecular weight of 298.35 g/mol. Its IUPAC name is N-(4-methyl-3-sulfamoylphenyl)thiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-(4-methyl-3-sulfamoylphenyl)thiadiazole-5-carboxamide
PubChem CID47332366
Molecular FormulaC10H10N4O3S2
Molecular Weight298.35 g/mol
Exact Mass298.02
IUPAC NameN-(4-methyl-3-sulfamoylphenyl)thiadiazole-5-carboxamide
SMILESCc1ccc(NC(=O)c2cnns2)cc1S(N)(=O)=O
InChIInChI=1S/C10H10N4O3S2/c1-6-2-3-7(4-9(6)19(11,16)17)13-10(15)8-5-12-14-18-8/h2-5H,1H3,(H,13,15)(H2,11,16,17)
InChIKeyKQYBAFSLWMEJFZ-UHFFFAOYSA-N
XLogP0.75
TPSA115.04 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-methyl-4-(thiadiazole-5-carbonylamino)benzenesulfonyl chloride
CID 65216260
2-methyl-N-(4-methyl-3-sulfamoylphenyl)-1,3-thiazole-4-carboxamide
CID 47445064
N-(4-methyl-3-sulfamoylphenyl)-2H-triazole-4-carboxamide
CID 47367376
N-(5-fluoro-2-sulfamoylphenyl)thiadiazole-5-carboxamide
CID 65215733
4-(thiadiazole-5-carbonylamino)benzenesulfonyl chloride
CID 65216096
N-[4-(3-aminoprop-1-ynyl)-3-methylphenyl]thiadiazole-5-carboxamide
CID 65214935
2,4-dimethyl-N-(4-methyl-3-sulfamoylphenyl)-1,3-oxazole-5-carboxamide
CID 79164756
5-(4-bromophenyl)-N-(4-methyl-3-sulfamoylphenyl)thiophene-2-carboxamide
CID 38736935
N-(4-acetylphenyl)thiadiazole-5-carboxamide
CID 47259424
3,5-dimethoxy-4-methyl-N-(4-methyl-3-sulfamoylphenyl)benzamide
CID 39764163
5-chloro-N-(4-methyl-3-sulfamoylphenyl)furan-2-carboxamide
CID 34186723
N-(4-methyl-3-sulfamoylphenyl)-2-phenyltriazole-4-carboxamide
CID 51255621

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-3-sulfamoylphenyl)thiadiazole-5-carboxamide?
The IUPAC name of N-(4-methyl-3-sulfamoylphenyl)thiadiazole-5-carboxamide (CID 47332366) is N-(4-methyl-3-sulfamoylphenyl)thiadiazole-5-carboxamide.
What is the SMILES notation for N-(4-methyl-3-sulfamoylphenyl)thiadiazole-5-carboxamide?
The canonical SMILES for N-(4-methyl-3-sulfamoylphenyl)thiadiazole-5-carboxamide is Cc1ccc(NC(=O)c2cnns2)cc1S(N)(=O)=O.
What is the InChIKey of N-(4-methyl-3-sulfamoylphenyl)thiadiazole-5-carboxamide?
The InChIKey is KQYBAFSLWMEJFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O3S2/c1-6-2-3-7(4-9(6)19(11,16)17)13-10(15)8-5-12-14-18-8/h2-5H,1H3,(H,13,15)(H2,11,16,17).
What are the key properties of N-(4-methyl-3-sulfamoylphenyl)thiadiazole-5-carboxamide?
N-(4-methyl-3-sulfamoylphenyl)thiadiazole-5-carboxamide has a molecular weight of 298.35 g/mol, XLogP of 0.75, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-3-sulfamoylphenyl)thiadiazole-5-carboxamide is sourced from PubChem (CID 47332366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).