Basic information
- Standard SMILES
CC(C)(NC(=O)c1nc2c(NC(=O)c3ccsc3)n[nH]c2s1)c1ccccc1- InChIKey
OQOQCNDDBANFOJ-UHFFFAOYSA-N- Molecular formula
- C19H17N5O2S2
- Average molar mass
- 411.5 g/mol
- Monoisotopic mass
- 411.08236715
Names & identifiers
- Preferred name
- N-(1-methyl-1-phenylethyl)-3-[(thiophene-3-carbonyl)amino]-1H-pyrazolo[4,3-d]thiazole-5-carboxamide
- IUPAC
- N-(2-phenylpropan-2-yl)-3-(thiophene-3-carbonylamino)-2H-pyrazolo[4,3-d][1,3]thiazole-5-carboxamide
Names & synonyms
SCHEMBL2978082OQOQCNDDBANFOJ-UHFFFAOYSA-NN-(1-methyl-1-phenylethyl)-3-[(thiophene-3-carbonyl)amino]-1H-pyrazolo[4,3-d]thiazole-5-carboxamide
Database identifiers
- PubChem CID
- 57775079
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 156 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 599
Related reactions
2 records
Compound notes
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