4-(3-bromo-4-ethoxy-5-methoxyphenyl)-8-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Chemical Structure Depiction of
4-(3-bromo-4-ethoxy-5-methoxyphenyl)-8-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
4-(3-bromo-4-ethoxy-5-methoxyphenyl)-8-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Compound characteristics
| Compound ID: | 8011-4340 |
| Compound Name: | 4-(3-bromo-4-ethoxy-5-methoxyphenyl)-8-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline |
| Molecular Weight: | 445.31 |
| Molecular Formula: | C21 H21 Br N2 O4 |
| Smiles: | CCOc1c(cc(cc1[Br])C1C2CC=CC2c2cc(ccc2N1)[N+]([O-])=O)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.6579 |
| logD: | 5.6579 |
| logSw: | -5.4816 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.63 |
| InChI Key: | PRULTHQJMVFROH-UHFFFAOYSA-N |