methyl 4-{2,5-dimethyl-3-[(4-methylpiperidin-1-yl)acetyl]-1H-pyrrol-1-yl}benzoate
Chemical Structure Depiction of
methyl 4-{2,5-dimethyl-3-[(4-methylpiperidin-1-yl)acetyl]-1H-pyrrol-1-yl}benzoate
methyl 4-{2,5-dimethyl-3-[(4-methylpiperidin-1-yl)acetyl]-1H-pyrrol-1-yl}benzoate
Compound characteristics
| Compound ID: | G625-0012 |
| Compound Name: | methyl 4-{2,5-dimethyl-3-[(4-methylpiperidin-1-yl)acetyl]-1H-pyrrol-1-yl}benzoate |
| Molecular Weight: | 368.48 |
| Molecular Formula: | C22 H28 N2 O3 |
| Smiles: | CC1CCN(CC1)CC(c1cc(C)n(c2ccc(cc2)C(=O)OC)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6174 |
| logD: | 2.3969 |
| logSw: | -3.6963 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.057 |
| InChI Key: | CLMJNQLZLXMONX-UHFFFAOYSA-N |