2-benzyl-8-(4-phenylbutanoyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
2-benzyl-8-(4-phenylbutanoyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
2-benzyl-8-(4-phenylbutanoyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0341 |
| Compound Name: | 2-benzyl-8-(4-phenylbutanoyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 405.54 |
| Molecular Formula: | C25 H31 N3 O2 |
| Smiles: | C(CC(N1CCC2C(N(CCN2CC1)Cc1ccccc1)=O)=O)Cc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0938 |
| logD: | 3.0888 |
| logSw: | -3.1772 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.275 |
| InChI Key: | MZGNFCKBWLYDTH-QHCPKHFHSA-N |