2,6-dibromo-4-nitrophenyl 4-(5-pentylpyridin-2-yl)benzoate
Chemical Structure Depiction of
2,6-dibromo-4-nitrophenyl 4-(5-pentylpyridin-2-yl)benzoate
2,6-dibromo-4-nitrophenyl 4-(5-pentylpyridin-2-yl)benzoate
Compound characteristics
| Compound ID: | 000L-4290 |
| Compound Name: | 2,6-dibromo-4-nitrophenyl 4-(5-pentylpyridin-2-yl)benzoate |
| Molecular Weight: | 548.23 |
| Molecular Formula: | C23 H20 Br2 N2 O4 |
| Smiles: | CCCCCc1ccc(c2ccc(cc2)C(=O)Oc2c(cc(cc2[Br])[N+]([O-])=O)[Br])nc1 |
| Stereo: | ACHIRAL |
| logP: | 8.3482 |
| logD: | 8.3456 |
| logSw: | -5.5467 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.037 |
| InChI Key: | MHJZVUZEZILXCQ-UHFFFAOYSA-N |