N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-2-(3-oxo-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-8-yl)acetamide
Chemical Structure Depiction of
N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-2-(3-oxo-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-8-yl)acetamide
N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-2-(3-oxo-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-8-yl)acetamide
Compound characteristics
| Compound ID: | SD18-0037 |
| Compound Name: | N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-2-(3-oxo-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-8-yl)acetamide |
| Molecular Weight: | 420.9 |
| Molecular Formula: | C19 H25 Cl N6 O3 |
| Smiles: | C(C1C2=NNC(N2CCO1)=O)C(NCCN1CCN(CC1)c1cccc(c1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8816 |
| logD: | 0.7432 |
| logSw: | -2.4333 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.803 |
| InChI Key: | MIYOYTVFVJUEQJ-INIZCTEOSA-N |