ethyl 3-[4-(4-methylpentanoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
Chemical Structure Depiction of
ethyl 3-[4-(4-methylpentanoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
ethyl 3-[4-(4-methylpentanoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
Compound characteristics
| Compound ID: | V019-5446 |
| Compound Name: | ethyl 3-[4-(4-methylpentanoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate |
| Molecular Weight: | 398.5 |
| Molecular Formula: | C22 H30 N4 O3 |
| Smiles: | CCOC(c1c(nc2ccccc2n1)N1CCCN(CC1)C(CCC(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0333 |
| logD: | 4.0333 |
| logSw: | -3.8934 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.612 |
| InChI Key: | GUXZYTQFPNPJFT-UHFFFAOYSA-N |