methyl 4-{2-[(4-cyanophenyl)carbamoyl]pyrrolidine-1-sulfonyl}-1-methyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{2-[(4-cyanophenyl)carbamoyl]pyrrolidine-1-sulfonyl}-1-methyl-1H-pyrrole-2-carboxylate
methyl 4-{2-[(4-cyanophenyl)carbamoyl]pyrrolidine-1-sulfonyl}-1-methyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F065-0128 |
| Compound Name: | methyl 4-{2-[(4-cyanophenyl)carbamoyl]pyrrolidine-1-sulfonyl}-1-methyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 416.45 |
| Molecular Formula: | C19 H20 N4 O5 S |
| Smiles: | Cn1cc(cc1C(=O)OC)S(N1CCCC1C(Nc1ccc(C#N)cc1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8878 |
| logD: | 0.8799 |
| logSw: | -2.3448 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.417 |
| InChI Key: | GEVUGAHXEVIFGC-INIZCTEOSA-N |