ethyl 4-[2-(azepane-1-carbonyl)pyrrolidine-1-sulfonyl]-1-methyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[2-(azepane-1-carbonyl)pyrrolidine-1-sulfonyl]-1-methyl-1H-pyrrole-2-carboxylate
ethyl 4-[2-(azepane-1-carbonyl)pyrrolidine-1-sulfonyl]-1-methyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F065-0454 |
| Compound Name: | ethyl 4-[2-(azepane-1-carbonyl)pyrrolidine-1-sulfonyl]-1-methyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 411.52 |
| Molecular Formula: | C19 H29 N3 O5 S |
| Smiles: | CCOC(c1cc(cn1C)S(N1CCCC1C(N1CCCCCC1)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5223 |
| logD: | 1.5223 |
| logSw: | -2.1328 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.829 |
| InChI Key: | AEGPPBLUGGENNF-INIZCTEOSA-N |