9-(5-chloro-2-fluorobenzoyl)octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
9-(5-chloro-2-fluorobenzoyl)octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
9-(5-chloro-2-fluorobenzoyl)octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | SD68-0033 |
| Compound Name: | 9-(5-chloro-2-fluorobenzoyl)octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 325.77 |
| Molecular Formula: | C15 H17 Cl F N3 O2 |
| Smiles: | C1CN2CCNC(C2CN(C1)C(c1cc(ccc1F)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1066 |
| logD: | 1.0913 |
| logSw: | -2.8612 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.39 |
| InChI Key: | FPTVYTIROVPTIV-ZDUSSCGKSA-N |