methyl 4-{2-[(2-bromo-4-methylphenyl)carbamoyl]pyrrolidine-1-sulfonyl}-1-methyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{2-[(2-bromo-4-methylphenyl)carbamoyl]pyrrolidine-1-sulfonyl}-1-methyl-1H-pyrrole-2-carboxylate
methyl 4-{2-[(2-bromo-4-methylphenyl)carbamoyl]pyrrolidine-1-sulfonyl}-1-methyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F065-0104 |
| Compound Name: | methyl 4-{2-[(2-bromo-4-methylphenyl)carbamoyl]pyrrolidine-1-sulfonyl}-1-methyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 484.37 |
| Molecular Formula: | C19 H22 Br N3 O5 S |
| Smiles: | Cc1ccc(c(c1)[Br])NC(C1CCCN1S(c1cc(C(=O)OC)n(C)c1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3133 |
| logD: | 2.3127 |
| logSw: | -2.8212 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.663 |
| InChI Key: | NIHUOYNWOFFORC-INIZCTEOSA-N |