[4-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(3-methylphenyl)pyrimidin-5-yl](4-ethylpiperazin-1-yl)methanone
Chemical Structure Depiction of
[4-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(3-methylphenyl)pyrimidin-5-yl](4-ethylpiperazin-1-yl)methanone
[4-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(3-methylphenyl)pyrimidin-5-yl](4-ethylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V028-0496 |
| Compound Name: | [4-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(3-methylphenyl)pyrimidin-5-yl](4-ethylpiperazin-1-yl)methanone |
| Molecular Weight: | 441.58 |
| Molecular Formula: | C27 H31 N5 O |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)C(c1cnc(c2cccc(C)c2)nc1N1CCc2ccccc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4171 |
| logD: | 4.2409 |
| logSw: | -4.129 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.292 |
| InChI Key: | MOEKGNOBIJZFFX-UHFFFAOYSA-N |