(3-chloro-1-benzothiophen-2-yl){3,5-dimethyl-4-[(4-methylphenyl)sulfanyl]-1H-pyrazol-1-yl}methanone
Chemical Structure Depiction of
(3-chloro-1-benzothiophen-2-yl){3,5-dimethyl-4-[(4-methylphenyl)sulfanyl]-1H-pyrazol-1-yl}methanone
(3-chloro-1-benzothiophen-2-yl){3,5-dimethyl-4-[(4-methylphenyl)sulfanyl]-1H-pyrazol-1-yl}methanone
Compound characteristics
| Compound ID: | 4676-0962 |
| Compound Name: | (3-chloro-1-benzothiophen-2-yl){3,5-dimethyl-4-[(4-methylphenyl)sulfanyl]-1H-pyrazol-1-yl}methanone |
| Molecular Weight: | 412.96 |
| Molecular Formula: | C21 H17 Cl N2 O S2 |
| Smiles: | Cc1ccc(cc1)Sc1c(C)nn(C(c2c(c3ccccc3s2)[Cl])=O)c1C |
| Stereo: | ACHIRAL |
| logP: | 5.7957 |
| logD: | 5.7957 |
| logSw: | -6.0279 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.3275 |
| InChI Key: | VCLBDACNVYXZBV-UHFFFAOYSA-N |