(3-chloro-6-nitro-1-benzothiophen-2-yl)(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)methanone
Chemical Structure Depiction of
(3-chloro-6-nitro-1-benzothiophen-2-yl)(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)methanone
(3-chloro-6-nitro-1-benzothiophen-2-yl)(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)methanone
Compound characteristics
| Compound ID: | 4477-1404 |
| Compound Name: | (3-chloro-6-nitro-1-benzothiophen-2-yl)(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)methanone |
| Molecular Weight: | 444.94 |
| Molecular Formula: | C22 H21 Cl N2 O4 S |
| Smiles: | CC1CC(C)(C)N(C(c2c(c3ccc(cc3s2)[N+]([O-])=O)[Cl])=O)c2ccc(cc12)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9167 |
| logD: | 5.9166 |
| logSw: | -6.2386 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.996 |
| InChI Key: | KKQLOHPYUZBDND-GFCCVEGCSA-N |