ethyl 3-{4-[(2S)-2-(acetyloxy)propanoyl]-1,4-diazepan-1-yl}-6,7-dichloroquinoxaline-2-carboxylate
Chemical Structure Depiction of
ethyl 3-{4-[(2S)-2-(acetyloxy)propanoyl]-1,4-diazepan-1-yl}-6,7-dichloroquinoxaline-2-carboxylate
ethyl 3-{4-[(2S)-2-(acetyloxy)propanoyl]-1,4-diazepan-1-yl}-6,7-dichloroquinoxaline-2-carboxylate
Compound characteristics
| Compound ID: | V007-7320 |
| Compound Name: | ethyl 3-{4-[(2S)-2-(acetyloxy)propanoyl]-1,4-diazepan-1-yl}-6,7-dichloroquinoxaline-2-carboxylate |
| Molecular Weight: | 483.35 |
| Molecular Formula: | C21 H24 Cl2 N4 O5 |
| Smiles: | CCOC(c1c(nc2cc(c(cc2n1)[Cl])[Cl])N1CCCN(CC1)C([C@H](C)OC(C)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8742 |
| logD: | 3.8742 |
| logSw: | -4.1237 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.661 |
| InChI Key: | WGEWQINJOJSCAN-LBPRGKRZSA-N |