4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6-(morpholin-4-yl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6-(morpholin-4-yl)pyrimidine-5-carbonitrile
4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6-(morpholin-4-yl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | G291-0075 |
| Compound Name: | 4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6-(morpholin-4-yl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 408.46 |
| Molecular Formula: | C21 H24 N6 O3 |
| Smiles: | C1CN(CCN1Cc1ccc2c(c1)OCO2)c1c(C#N)c(ncn1)N1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 2.4287 |
| logD: | 2.0547 |
| logSw: | -2.5779 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 72.44 |
| InChI Key: | JQDJCTPUJFBGTJ-UHFFFAOYSA-N |