N-(4-bromophenyl)-2-(2-methoxyethyl)-1-oxooctahydropyrazino[1,2-a][1,4]diazepine-9(6H)-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-(2-methoxyethyl)-1-oxooctahydropyrazino[1,2-a][1,4]diazepine-9(6H)-carboxamide
N-(4-bromophenyl)-2-(2-methoxyethyl)-1-oxooctahydropyrazino[1,2-a][1,4]diazepine-9(6H)-carboxamide
Compound characteristics
| Compound ID: | SD68-0453 |
| Compound Name: | N-(4-bromophenyl)-2-(2-methoxyethyl)-1-oxooctahydropyrazino[1,2-a][1,4]diazepine-9(6H)-carboxamide |
| Molecular Weight: | 425.32 |
| Molecular Formula: | C18 H25 Br N4 O3 |
| Smiles: | COCCN1CCN2CCCN(CC2C1=O)C(Nc1ccc(cc1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6504 |
| logD: | 1.1668 |
| logSw: | -2.2053 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.149 |
| InChI Key: | QMMNRUJZGCVVMC-INIZCTEOSA-N |