2-chloro-5-methylphenyl 3-amino-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
2-chloro-5-methylphenyl 3-amino-1-benzothiophene-2-carboxylate
2-chloro-5-methylphenyl 3-amino-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | G891-0045 |
| Compound Name: | 2-chloro-5-methylphenyl 3-amino-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 317.79 |
| Molecular Formula: | C16 H12 Cl N O2 S |
| Smiles: | Cc1ccc(c(c1)OC(c1c(c2ccccc2s1)N)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.5785 |
| logD: | 4.5785 |
| logSw: | -4.6688 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.836 |
| InChI Key: | YNVKPMCGSANQGQ-UHFFFAOYSA-N |