2-(2-chloro-5-methylphenoxy)-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide
Chemical Structure Depiction of
2-(2-chloro-5-methylphenoxy)-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide
2-(2-chloro-5-methylphenoxy)-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide
Compound characteristics
| Compound ID: | Y203-0031 |
| Compound Name: | 2-(2-chloro-5-methylphenoxy)-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide |
| Molecular Weight: | 402.94 |
| Molecular Formula: | C21 H23 Cl N2 O2 S |
| Smiles: | CCC1CCc2c(C#N)c(NC(C(C)Oc3cc(C)ccc3[Cl])=O)sc2C1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.1228 |
| logD: | 4.7048 |
| logSw: | -6.287 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.977 |
| InChI Key: | BGOGLCBOARSAKG-UHFFFAOYSA-N |