ethyl 5-[3-(azepan-1-yl)-3-oxopropyl]-1-ethyl-2,4-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[3-(azepan-1-yl)-3-oxopropyl]-1-ethyl-2,4-dimethyl-1H-pyrrole-3-carboxylate
ethyl 5-[3-(azepan-1-yl)-3-oxopropyl]-1-ethyl-2,4-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G726-1480 |
| Compound Name: | ethyl 5-[3-(azepan-1-yl)-3-oxopropyl]-1-ethyl-2,4-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 348.48 |
| Molecular Formula: | C20 H32 N2 O3 |
| Smiles: | CCn1c(C)c(C(=O)OCC)c(C)c1CCC(N1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2886 |
| logD: | 3.2886 |
| logSw: | -3.3157 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.648 |
| InChI Key: | SRFCDRNYFAVBGY-UHFFFAOYSA-N |