4-(4-benzylpiperazine-1-carbonyl)-2-cyclopropyl-3-(3-methoxyphenyl)-3,4-dihydroisoquinolin-1(2H)-one
Chemical Structure Depiction of
4-(4-benzylpiperazine-1-carbonyl)-2-cyclopropyl-3-(3-methoxyphenyl)-3,4-dihydroisoquinolin-1(2H)-one
4-(4-benzylpiperazine-1-carbonyl)-2-cyclopropyl-3-(3-methoxyphenyl)-3,4-dihydroisoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | V017-7560 |
| Compound Name: | 4-(4-benzylpiperazine-1-carbonyl)-2-cyclopropyl-3-(3-methoxyphenyl)-3,4-dihydroisoquinolin-1(2H)-one |
| Molecular Weight: | 495.62 |
| Molecular Formula: | C31 H33 N3 O3 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)C1C(C(N2CCN(CC2)Cc2ccccc2)=O)c2ccccc2C(N1C1CC1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.1739 |
| logD: | 4.1275 |
| logSw: | -4.306 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.936 |
| InChI Key: | FQVPMCRTEFWZQU-UHFFFAOYSA-N |