8-[3-(2-methoxyphenyl)propanoyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
8-[3-(2-methoxyphenyl)propanoyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
8-[3-(2-methoxyphenyl)propanoyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0047 |
| Compound Name: | 8-[3-(2-methoxyphenyl)propanoyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 331.41 |
| Molecular Formula: | C18 H25 N3 O3 |
| Smiles: | COc1ccccc1CCC(N1CCC2C(NCCN2CC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7135 |
| logD: | 0.6214 |
| logSw: | -1.7689 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.559 |
| InChI Key: | KVTCYRIWKBITCQ-HNNXBMFYSA-N |