4-(4-benzylpiperidine-1-carbonyl)-2-(3-methoxyphenyl)isoquinolin-1(2H)-one
Chemical Structure Depiction of
4-(4-benzylpiperidine-1-carbonyl)-2-(3-methoxyphenyl)isoquinolin-1(2H)-one
4-(4-benzylpiperidine-1-carbonyl)-2-(3-methoxyphenyl)isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | E456-2088 |
| Compound Name: | 4-(4-benzylpiperidine-1-carbonyl)-2-(3-methoxyphenyl)isoquinolin-1(2H)-one |
| Molecular Weight: | 452.55 |
| Molecular Formula: | C29 H28 N2 O3 |
| Smiles: | COc1cccc(c1)N1C=C(C(N2CCC(CC2)Cc2ccccc2)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 4.9024 |
| logD: | 4.9024 |
| logSw: | -4.8171 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.675 |
| InChI Key: | XZKOWBUQOBBYDP-UHFFFAOYSA-N |