(3-chloro-6-methyl-1-benzothiophen-2-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
(3-chloro-6-methyl-1-benzothiophen-2-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
(3-chloro-6-methyl-1-benzothiophen-2-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | Y203-7269 |
| Compound Name: | (3-chloro-6-methyl-1-benzothiophen-2-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 415.9 |
| Molecular Formula: | C20 H18 Cl N3 O3 S |
| Smiles: | Cc1ccc2c(c(C(N3CCN(CC3)c3ccc(cc3)[N+]([O-])=O)=O)sc2c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.2782 |
| logD: | 5.2782 |
| logSw: | -5.8783 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.275 |
| InChI Key: | QKLRGQRCJBEUIX-UHFFFAOYSA-N |