methyl 3-amino-4-(4-methylbenzene-1-sulfonyl)-5-(methylsulfanyl)thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-amino-4-(4-methylbenzene-1-sulfonyl)-5-(methylsulfanyl)thiophene-2-carboxylate
methyl 3-amino-4-(4-methylbenzene-1-sulfonyl)-5-(methylsulfanyl)thiophene-2-carboxylate
Compound characteristics
| Compound ID: | C201-0463 |
| Compound Name: | methyl 3-amino-4-(4-methylbenzene-1-sulfonyl)-5-(methylsulfanyl)thiophene-2-carboxylate |
| Molecular Weight: | 357.47 |
| Molecular Formula: | C14 H15 N O4 S3 |
| Smiles: | Cc1ccc(cc1)S(c1c(c(C(=O)OC)sc1SC)N)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3205 |
| logD: | 3.3205 |
| logSw: | -3.5116 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.318 |
| InChI Key: | HKAYIDGZJMEGET-UHFFFAOYSA-N |