4-[(2H-1,3-benzodioxol-5-yl)oxy]-6-(4-methylpiperazin-1-yl)pyrimidin-5-amine
Chemical Structure Depiction of
4-[(2H-1,3-benzodioxol-5-yl)oxy]-6-(4-methylpiperazin-1-yl)pyrimidin-5-amine
4-[(2H-1,3-benzodioxol-5-yl)oxy]-6-(4-methylpiperazin-1-yl)pyrimidin-5-amine
Compound characteristics
Compound ID: | V029-9528 |
Compound Name: | 4-[(2H-1,3-benzodioxol-5-yl)oxy]-6-(4-methylpiperazin-1-yl)pyrimidin-5-amine |
Molecular Weight: | 329.36 |
Molecular Formula: | C16 H19 N5 O3 |
Salt: | not_available |
Smiles: | CN1CCN(CC1)c1c(c(ncn1)Oc1ccc2c(c1)OCO2)N |
Stereo: | ACHIRAL |
logP: | 1.9094 |
logD: | 1.4327 |
logSw: | -2.3505 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 70.917 |
InChI Key: | YSWFEFZTYFUSTD-UHFFFAOYSA-N |