1-[4-(3,4-difluorophenoxy)-2-(4-methylpiperazin-1-yl)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl]-2-phenylbutan-1-one
Chemical Structure Depiction of
1-[4-(3,4-difluorophenoxy)-2-(4-methylpiperazin-1-yl)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl]-2-phenylbutan-1-one
1-[4-(3,4-difluorophenoxy)-2-(4-methylpiperazin-1-yl)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl]-2-phenylbutan-1-one
Compound characteristics
| Compound ID: | V021-0575 |
| Compound Name: | 1-[4-(3,4-difluorophenoxy)-2-(4-methylpiperazin-1-yl)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl]-2-phenylbutan-1-one |
| Molecular Weight: | 507.58 |
| Molecular Formula: | C28 H31 F2 N5 O2 |
| Salt: | not_available |
| Smiles: | CCC(C(N1CCc2c(C1)c(nc(n2)N1CCN(C)CC1)Oc1ccc(c(c1)F)F)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1579 |
| logD: | 4.5861 |
| logSw: | -5.1201 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.982 |
| InChI Key: | IOSKCWPSHCEODH-OAQYLSRUSA-N |