9-chloro-3,5-dihydro[1,2,4]triazino[3,4-c][1,4]benzoxazin-2(1H)-one
Chemical Structure Depiction of
9-chloro-3,5-dihydro[1,2,4]triazino[3,4-c][1,4]benzoxazin-2(1H)-one
9-chloro-3,5-dihydro[1,2,4]triazino[3,4-c][1,4]benzoxazin-2(1H)-one
Compound characteristics
| Compound ID: | 8539-0487 |
| Compound Name: | 9-chloro-3,5-dihydro[1,2,4]triazino[3,4-c][1,4]benzoxazin-2(1H)-one |
| Molecular Weight: | 237.64 |
| Molecular Formula: | C10 H8 Cl N3 O2 |
| Smiles: | C1C(NN=C2COc3ccc(cc3N12)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 1.1772 |
| logD: | -2.0677 |
| logSw: | -2.6235 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.292 |
| InChI Key: | PQVKHHQTUSMCTQ-UHFFFAOYSA-N |