cyclopentyl 4-(4-chloro-3-nitrophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
cyclopentyl 4-(4-chloro-3-nitrophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
cyclopentyl 4-(4-chloro-3-nitrophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | C276-1548 |
| Compound Name: | cyclopentyl 4-(4-chloro-3-nitrophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 378.81 |
| Molecular Formula: | C18 H19 Cl N2 O5 |
| Smiles: | CC1=C(C(CC(N1)=O)c1ccc(c(c1)[N+]([O-])=O)[Cl])C(=O)OC1CCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1041 |
| logD: | 2.1641 |
| logSw: | -3.6798 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.97 |
| InChI Key: | QIWHDXIPFMGRJY-ZDUSSCGKSA-N |