3-(5-chloro-2-methoxyphenyl)-N-(2-methoxyethyl)-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
3-(5-chloro-2-methoxyphenyl)-N-(2-methoxyethyl)-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-(5-chloro-2-methoxyphenyl)-N-(2-methoxyethyl)-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V003-7284 |
| Compound Name: | 3-(5-chloro-2-methoxyphenyl)-N-(2-methoxyethyl)-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 474.94 |
| Molecular Formula: | C23 H27 Cl N4 O5 |
| Smiles: | COCCNC(C1Cc2cc(ccc2N2CCN(CC12)c1cc(ccc1OC)[Cl])[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3401 |
| logD: | 3.34 |
| logSw: | -3.7763 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.383 |
| InChI Key: | RUENFLHIVVEVPP-UHFFFAOYSA-N |