methyl 4-[3-(5-bromothiophene-2-sulfonyl)propanamido]benzoate
Chemical Structure Depiction of
methyl 4-[3-(5-bromothiophene-2-sulfonyl)propanamido]benzoate
methyl 4-[3-(5-bromothiophene-2-sulfonyl)propanamido]benzoate
Compound characteristics
| Compound ID: | C224-4334 |
| Compound Name: | methyl 4-[3-(5-bromothiophene-2-sulfonyl)propanamido]benzoate |
| Molecular Weight: | 432.31 |
| Molecular Formula: | C15 H14 Br N O5 S2 |
| Smiles: | COC(c1ccc(cc1)NC(CCS(c1ccc(s1)[Br])(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0507 |
| logD: | 3.0504 |
| logSw: | -3.6251 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.345 |
| InChI Key: | GAIDRBHRRNCRQG-UHFFFAOYSA-N |