N,4-bis(2-methylpropyl)-5-oxo-1-sulfanylidene-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
Chemical Structure Depiction of
N,4-bis(2-methylpropyl)-5-oxo-1-sulfanylidene-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
N,4-bis(2-methylpropyl)-5-oxo-1-sulfanylidene-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | C200-7285 |
| Compound Name: | N,4-bis(2-methylpropyl)-5-oxo-1-sulfanylidene-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide |
| Molecular Weight: | 373.48 |
| Molecular Formula: | C18 H23 N5 O2 S |
| Smiles: | CC(C)CNC(c1ccc2C(N(CC(C)C)C3=NNC(N3c2c1)=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7396 |
| logD: | -4.3822 |
| logSw: | -3.444 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.331 |
| InChI Key: | OKALSGYKODLIMU-UHFFFAOYSA-N |