2-benzyl-8-[3-(2-methoxyphenyl)propanoyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
2-benzyl-8-[3-(2-methoxyphenyl)propanoyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
2-benzyl-8-[3-(2-methoxyphenyl)propanoyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0374 |
| Compound Name: | 2-benzyl-8-[3-(2-methoxyphenyl)propanoyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 421.54 |
| Molecular Formula: | C25 H31 N3 O3 |
| Smiles: | COc1ccccc1CCC(N1CCC2C(N(CCN2CC1)Cc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5007 |
| logD: | 2.4958 |
| logSw: | -2.2615 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.905 |
| InChI Key: | HNIBNIFNUITAQK-QFIPXVFZSA-N |