ethyl 4-{2-[(4-bromo-3-methylphenyl)carbamoyl]pyrrolidine-1-sulfonyl}-1-methyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-{2-[(4-bromo-3-methylphenyl)carbamoyl]pyrrolidine-1-sulfonyl}-1-methyl-1H-pyrrole-2-carboxylate
ethyl 4-{2-[(4-bromo-3-methylphenyl)carbamoyl]pyrrolidine-1-sulfonyl}-1-methyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F065-0525 |
| Compound Name: | ethyl 4-{2-[(4-bromo-3-methylphenyl)carbamoyl]pyrrolidine-1-sulfonyl}-1-methyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 498.39 |
| Molecular Formula: | C20 H24 Br N3 O5 S |
| Smiles: | CCOC(c1cc(cn1C)S(N1CCCC1C(Nc1ccc(c(C)c1)[Br])=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8629 |
| logD: | 2.861 |
| logSw: | -3.2472 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.941 |
| InChI Key: | XUHQJSHROPIYBR-KRWDZBQOSA-N |