N-[2-(2,6-difluorobenzoyl)-3-(pyrrolidine-1-carbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]acetamide
Chemical Structure Depiction of
N-[2-(2,6-difluorobenzoyl)-3-(pyrrolidine-1-carbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]acetamide
N-[2-(2,6-difluorobenzoyl)-3-(pyrrolidine-1-carbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]acetamide
Compound characteristics
| Compound ID: | M563-0757 |
| Compound Name: | N-[2-(2,6-difluorobenzoyl)-3-(pyrrolidine-1-carbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]acetamide |
| Molecular Weight: | 427.45 |
| Molecular Formula: | C23 H23 F2 N3 O3 |
| Smiles: | CC(Nc1ccc2CC(C(N3CCCC3)=O)N(Cc2c1)C(c1c(cccc1F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.695 |
| logD: | 2.695 |
| logSw: | -3.0879 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.519 |
| InChI Key: | VRRPMPCUMIFDQX-FQEVSTJZSA-N |