4-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(4-methoxyphenyl)-N-[(pyridin-3-yl)methyl]pyrimidine-5-carboxamide
Chemical Structure Depiction of
4-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(4-methoxyphenyl)-N-[(pyridin-3-yl)methyl]pyrimidine-5-carboxamide
4-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(4-methoxyphenyl)-N-[(pyridin-3-yl)methyl]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | V007-4729 |
| Compound Name: | 4-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(4-methoxyphenyl)-N-[(pyridin-3-yl)methyl]pyrimidine-5-carboxamide |
| Molecular Weight: | 451.53 |
| Molecular Formula: | C27 H25 N5 O2 |
| Smiles: | COc1ccc(cc1)c1ncc(C(NCc2cccnc2)=O)c(n1)N1CCc2ccccc2C1 |
| Stereo: | ACHIRAL |
| logP: | 4.3809 |
| logD: | 4.3797 |
| logSw: | -3.9549 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.582 |
| InChI Key: | LLSHVIYHDYQDSC-UHFFFAOYSA-N |