ethyl 1-(2-{[3-(azepan-1-yl)propyl]amino}-2-oxoethyl)-2,4-dimethyl-5-phenyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-(2-{[3-(azepan-1-yl)propyl]amino}-2-oxoethyl)-2,4-dimethyl-5-phenyl-1H-pyrrole-3-carboxylate
ethyl 1-(2-{[3-(azepan-1-yl)propyl]amino}-2-oxoethyl)-2,4-dimethyl-5-phenyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | C721-0252 |
| Compound Name: | ethyl 1-(2-{[3-(azepan-1-yl)propyl]amino}-2-oxoethyl)-2,4-dimethyl-5-phenyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 439.6 |
| Molecular Formula: | C26 H37 N3 O3 |
| Smiles: | CCOC(c1c(C)c(c2ccccc2)n(CC(NCCCN2CCCCCC2)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.811 |
| logD: | 1.1824 |
| logSw: | -3.9315 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.074 |
| InChI Key: | IWJTWZUEXRGDKP-UHFFFAOYSA-N |