1-{3-[5-amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]phenyl}ethan-1-one
Chemical Structure Depiction of
1-{3-[5-amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]phenyl}ethan-1-one
1-{3-[5-amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]phenyl}ethan-1-one
Compound characteristics
| Compound ID: | V030-7364 |
| Compound Name: | 1-{3-[5-amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]phenyl}ethan-1-one |
| Molecular Weight: | 311.38 |
| Molecular Formula: | C17 H21 N5 O |
| Salt: | not_available |
| Smiles: | CC(c1cccc(c1)c1c(c(ncn1)N1CCN(C)CC1)N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5159 |
| logD: | 1.0393 |
| logSw: | -1.8661 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.622 |
| InChI Key: | CYIWYZLGCSOFEN-UHFFFAOYSA-N |