N-[2-(4-chlorobenzoyl)-3-(pyrrolidine-1-carbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]propanamide
Chemical Structure Depiction of
N-[2-(4-chlorobenzoyl)-3-(pyrrolidine-1-carbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]propanamide
N-[2-(4-chlorobenzoyl)-3-(pyrrolidine-1-carbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]propanamide
Compound characteristics
| Compound ID: | M563-0005 |
| Compound Name: | N-[2-(4-chlorobenzoyl)-3-(pyrrolidine-1-carbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]propanamide |
| Molecular Weight: | 439.94 |
| Molecular Formula: | C24 H26 Cl N3 O3 |
| Smiles: | CCC(Nc1ccc2CC(C(N3CCCC3)=O)N(Cc2c1)C(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7576 |
| logD: | 3.7576 |
| logSw: | -4.2946 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.406 |
| InChI Key: | XKQIXUXRJZVZHQ-NRFANRHFSA-N |