3-{[4-(4-methoxyphenoxy)-2-(4-methylpiperazin-1-yl)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl]methyl}benzonitrile
Chemical Structure Depiction of
3-{[4-(4-methoxyphenoxy)-2-(4-methylpiperazin-1-yl)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl]methyl}benzonitrile
3-{[4-(4-methoxyphenoxy)-2-(4-methylpiperazin-1-yl)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl]methyl}benzonitrile
Compound characteristics
| Compound ID: | V015-0807 |
| Compound Name: | 3-{[4-(4-methoxyphenoxy)-2-(4-methylpiperazin-1-yl)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl]methyl}benzonitrile |
| Molecular Weight: | 470.57 |
| Molecular Formula: | C27 H30 N6 O2 |
| Salt: | not_available |
| Smiles: | CN1CCN(CC1)c1nc2CCN(Cc3cccc(C#N)c3)Cc2c(n1)Oc1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.0072 |
| logD: | 3.4354 |
| logSw: | -4.2955 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.666 |
| InChI Key: | XFXZNVKHKJOMST-UHFFFAOYSA-N |