2-ethyl-1-[4-(3-phenylquinoxalin-2-yl)-1,4-diazepan-1-yl]butan-1-one
Chemical Structure Depiction of
2-ethyl-1-[4-(3-phenylquinoxalin-2-yl)-1,4-diazepan-1-yl]butan-1-one
2-ethyl-1-[4-(3-phenylquinoxalin-2-yl)-1,4-diazepan-1-yl]butan-1-one
Compound characteristics
| Compound ID: | V003-9527 |
| Compound Name: | 2-ethyl-1-[4-(3-phenylquinoxalin-2-yl)-1,4-diazepan-1-yl]butan-1-one |
| Molecular Weight: | 402.54 |
| Molecular Formula: | C25 H30 N4 O |
| Salt: | not_available |
| Smiles: | CCC(CC)C(N1CCCN(CC1)c1c(c2ccccc2)nc2ccccc2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3985 |
| logD: | 5.3983 |
| logSw: | -5.3181 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.114 |
| InChI Key: | VLBBWCSQUYWJQK-UHFFFAOYSA-N |