methyl {1-[(3,4-dichlorophenyl)carbamoyl]-3-oxodecahydroquinoxalin-2-yl}acetate
Chemical Structure Depiction of
methyl {1-[(3,4-dichlorophenyl)carbamoyl]-3-oxodecahydroquinoxalin-2-yl}acetate
methyl {1-[(3,4-dichlorophenyl)carbamoyl]-3-oxodecahydroquinoxalin-2-yl}acetate
Compound characteristics
| Compound ID: | 6456-0634 |
| Compound Name: | methyl {1-[(3,4-dichlorophenyl)carbamoyl]-3-oxodecahydroquinoxalin-2-yl}acetate |
| Molecular Weight: | 414.29 |
| Molecular Formula: | C18 H21 Cl2 N3 O4 |
| Smiles: | COC(CC1C(NC2CCCCC2N1C(Nc1ccc(c(c1)[Cl])[Cl])=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0642 |
| logD: | 3.0641 |
| logSw: | -3.5521 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.187 |
| InChI Key: | NKAZTDXWNRMOHP-UHFFFAOYSA-N |