4-amino-N-benzyl-2-(3,4-dihydroisoquinolin-2(1H)-yl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
4-amino-N-benzyl-2-(3,4-dihydroisoquinolin-2(1H)-yl)pyrimidine-5-carboxamide
4-amino-N-benzyl-2-(3,4-dihydroisoquinolin-2(1H)-yl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | M503-1171 |
| Compound Name: | 4-amino-N-benzyl-2-(3,4-dihydroisoquinolin-2(1H)-yl)pyrimidine-5-carboxamide |
| Molecular Weight: | 359.43 |
| Molecular Formula: | C21 H21 N5 O |
| Smiles: | C1CN(Cc2ccccc12)c1ncc(C(NCc2ccccc2)=O)c(N)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.8937 |
| logD: | 2.8894 |
| logSw: | -3.385 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 66.483 |
| InChI Key: | JFQDGYHQMZJTLF-UHFFFAOYSA-N |