N-(butan-2-yl)-5-oxo-4-propyl-1-sulfanylidene-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
Chemical Structure Depiction of
N-(butan-2-yl)-5-oxo-4-propyl-1-sulfanylidene-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
N-(butan-2-yl)-5-oxo-4-propyl-1-sulfanylidene-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | C200-7689 |
| Compound Name: | N-(butan-2-yl)-5-oxo-4-propyl-1-sulfanylidene-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide |
| Molecular Weight: | 359.45 |
| Molecular Formula: | C17 H21 N5 O2 S |
| Smiles: | CCCN1C2=NNC(N2c2cc(ccc2C1=O)C(NC(C)CC)=O)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9821 |
| logD: | -5.1397 |
| logSw: | -2.8502 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.751 |
| InChI Key: | WVBLEKKOFZOQMX-JTQLQIEISA-N |