4-(benzylsulfanyl)-3-chloro-6-nitro-2-phenyl-1-benzothiophene
Chemical Structure Depiction of
4-(benzylsulfanyl)-3-chloro-6-nitro-2-phenyl-1-benzothiophene
4-(benzylsulfanyl)-3-chloro-6-nitro-2-phenyl-1-benzothiophene
Compound characteristics
| Compound ID: | 8019-6379 |
| Compound Name: | 4-(benzylsulfanyl)-3-chloro-6-nitro-2-phenyl-1-benzothiophene |
| Molecular Weight: | 411.93 |
| Molecular Formula: | C21 H14 Cl N O2 S2 |
| Smiles: | C(c1ccccc1)Sc1cc(cc2c1c(c(c1ccccc1)s2)[Cl])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 6.8127 |
| logD: | 6.8127 |
| logSw: | -6.9019 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.824 |
| InChI Key: | ZHYBVBMNGYEHOW-UHFFFAOYSA-N |