4-tert-butylphenyl 3-chloro-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
4-tert-butylphenyl 3-chloro-1-benzothiophene-2-carboxylate
4-tert-butylphenyl 3-chloro-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | 7883-7998 |
| Compound Name: | 4-tert-butylphenyl 3-chloro-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 344.86 |
| Molecular Formula: | C19 H17 Cl O2 S |
| Smiles: | CC(C)(C)c1ccc(cc1)OC(c1c(c2ccccc2s1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.7839 |
| logD: | 6.7839 |
| logSw: | -6.4496 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 21.363 |
| InChI Key: | MRBNXEYXXHLLIH-UHFFFAOYSA-N |