3-(3-acetyl-2-methyl-5-phenyl-1H-pyrrol-1-yl)-1-(azepan-1-yl)propan-1-one
Chemical Structure Depiction of
3-(3-acetyl-2-methyl-5-phenyl-1H-pyrrol-1-yl)-1-(azepan-1-yl)propan-1-one
3-(3-acetyl-2-methyl-5-phenyl-1H-pyrrol-1-yl)-1-(azepan-1-yl)propan-1-one
Compound characteristics
| Compound ID: | K906-2716 |
| Compound Name: | 3-(3-acetyl-2-methyl-5-phenyl-1H-pyrrol-1-yl)-1-(azepan-1-yl)propan-1-one |
| Molecular Weight: | 352.48 |
| Molecular Formula: | C22 H28 N2 O2 |
| Smiles: | CC(c1cc(c2ccccc2)n(CCC(N2CCCCCC2)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.742 |
| logD: | 3.742 |
| logSw: | -3.8835 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.4464 |
| InChI Key: | UTLISFQXUXSEDV-UHFFFAOYSA-N |