2-(4-methoxyphenyl)-3-oxo-N-{4-[(pyrrolidin-1-yl)methyl]phenyl}-2,3-dihydro-1H-isoindole-4-carboxamide
Chemical Structure Depiction of
2-(4-methoxyphenyl)-3-oxo-N-{4-[(pyrrolidin-1-yl)methyl]phenyl}-2,3-dihydro-1H-isoindole-4-carboxamide
2-(4-methoxyphenyl)-3-oxo-N-{4-[(pyrrolidin-1-yl)methyl]phenyl}-2,3-dihydro-1H-isoindole-4-carboxamide
Compound characteristics
| Compound ID: | C447-1421 |
| Compound Name: | 2-(4-methoxyphenyl)-3-oxo-N-{4-[(pyrrolidin-1-yl)methyl]phenyl}-2,3-dihydro-1H-isoindole-4-carboxamide |
| Molecular Weight: | 441.53 |
| Molecular Formula: | C27 H27 N3 O3 |
| Smiles: | COc1ccc(cc1)N1Cc2cccc(C(Nc3ccc(CN4CCCC4)cc3)=O)c2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.9646 |
| logD: | 1.953 |
| logSw: | -4.1632 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.173 |
| InChI Key: | YJLWZQARZAQAOO-UHFFFAOYSA-N |