1-{6-methyl-1-phenyl-4-[4-(pyridin-2-yl)piperazin-1-yl]-2-sulfanylidene-1,2-dihydropyrimidin-5-yl}ethan-1-one
Chemical Structure Depiction of
1-{6-methyl-1-phenyl-4-[4-(pyridin-2-yl)piperazin-1-yl]-2-sulfanylidene-1,2-dihydropyrimidin-5-yl}ethan-1-one
1-{6-methyl-1-phenyl-4-[4-(pyridin-2-yl)piperazin-1-yl]-2-sulfanylidene-1,2-dihydropyrimidin-5-yl}ethan-1-one
Compound characteristics
| Compound ID: | 8015-2039 |
| Compound Name: | 1-{6-methyl-1-phenyl-4-[4-(pyridin-2-yl)piperazin-1-yl]-2-sulfanylidene-1,2-dihydropyrimidin-5-yl}ethan-1-one |
| Molecular Weight: | 405.52 |
| Molecular Formula: | C22 H23 N5 O S |
| Smiles: | CC1=C(C(=NC(N1c1ccccc1)=S)N1CCN(CC1)c1ccccn1)C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6927 |
| logD: | 2.6838 |
| logSw: | -2.768 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.465 |
| InChI Key: | ZFGQVYASTUFKOI-UHFFFAOYSA-N |