3-methylphenyl 3-chloro-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
3-methylphenyl 3-chloro-1-benzothiophene-2-carboxylate
3-methylphenyl 3-chloro-1-benzothiophene-2-carboxylate
Compound characteristics
Compound ID: | 7883-8683 |
Compound Name: | 3-methylphenyl 3-chloro-1-benzothiophene-2-carboxylate |
Molecular Weight: | 302.78 |
Molecular Formula: | C16 H11 Cl O2 S |
Smiles: | Cc1cccc(c1)OC(c1c(c2ccccc2s1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 5.3947 |
logD: | 5.3947 |
logSw: | -6.0071 |
Hydrogen bond acceptors count: | 3 |
Polar surface area: | 21.363 |
InChI Key: | UFZXHUMPYFVYNA-UHFFFAOYSA-N |