N-(3-methylbutyl)-2-[(3-methylphenyl)methyl]-1-oxooctahydropyrazino[1,2-d][1,4]diazepine-8(2H)-carboxamide
Chemical Structure Depiction of
N-(3-methylbutyl)-2-[(3-methylphenyl)methyl]-1-oxooctahydropyrazino[1,2-d][1,4]diazepine-8(2H)-carboxamide
N-(3-methylbutyl)-2-[(3-methylphenyl)methyl]-1-oxooctahydropyrazino[1,2-d][1,4]diazepine-8(2H)-carboxamide
Compound characteristics
| Compound ID: | S994-0501 |
| Compound Name: | N-(3-methylbutyl)-2-[(3-methylphenyl)methyl]-1-oxooctahydropyrazino[1,2-d][1,4]diazepine-8(2H)-carboxamide |
| Molecular Weight: | 386.54 |
| Molecular Formula: | C22 H34 N4 O2 |
| Smiles: | CC(C)CCNC(N1CCC2C(N(CCN2CC1)Cc1cccc(C)c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0686 |
| logD: | 2.8891 |
| logSw: | -3.1156 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.058 |
| InChI Key: | SLIADXNMKNGWDN-FQEVSTJZSA-N |