2,2,4-trimethyl-1,2-dihydroquinolin-6-yl 4-chloro-3-nitrobenzoate
Chemical Structure Depiction of
2,2,4-trimethyl-1,2-dihydroquinolin-6-yl 4-chloro-3-nitrobenzoate
2,2,4-trimethyl-1,2-dihydroquinolin-6-yl 4-chloro-3-nitrobenzoate
Compound characteristics
| Compound ID: | 8010-1647 |
| Compound Name: | 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl 4-chloro-3-nitrobenzoate |
| Molecular Weight: | 372.81 |
| Molecular Formula: | C19 H17 Cl N2 O4 |
| Smiles: | CC1=CC(C)(C)Nc2ccc(cc12)OC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6606 |
| logD: | 4.6606 |
| logSw: | -4.9493 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.896 |
| InChI Key: | DOHRGFGQDUCFAU-UHFFFAOYSA-N |