(3-chloro-6-nitro-1-benzothiophen-2-yl)[4-(4-chlorophenyl)-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl]methanone
Chemical Structure Depiction of
(3-chloro-6-nitro-1-benzothiophen-2-yl)[4-(4-chlorophenyl)-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl]methanone
(3-chloro-6-nitro-1-benzothiophen-2-yl)[4-(4-chlorophenyl)-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl]methanone
Compound characteristics
| Compound ID: | Y020-5059 |
| Compound Name: | (3-chloro-6-nitro-1-benzothiophen-2-yl)[4-(4-chlorophenyl)-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl]methanone |
| Molecular Weight: | 525.45 |
| Molecular Formula: | C27 H22 Cl2 N2 O3 S |
| Smiles: | CC1(CC(C)(C)N(C(c2c(c3ccc(cc3s2)[N+]([O-])=O)[Cl])=O)c2ccccc12)c1ccc(cc1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 8.0034 |
| logD: | 8.0034 |
| logSw: | -6.5576 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.181 |
| InChI Key: | CZUBDSAMSXMHNS-MHZLTWQESA-N |