1-[1-benzyl-6-methyl-4-(4-phenylpiperazin-1-yl)-2-sulfanylidene-1,2-dihydropyrimidin-5-yl]ethan-1-one
Chemical Structure Depiction of
1-[1-benzyl-6-methyl-4-(4-phenylpiperazin-1-yl)-2-sulfanylidene-1,2-dihydropyrimidin-5-yl]ethan-1-one
1-[1-benzyl-6-methyl-4-(4-phenylpiperazin-1-yl)-2-sulfanylidene-1,2-dihydropyrimidin-5-yl]ethan-1-one
Compound characteristics
| Compound ID: | 6623-1044 |
| Compound Name: | 1-[1-benzyl-6-methyl-4-(4-phenylpiperazin-1-yl)-2-sulfanylidene-1,2-dihydropyrimidin-5-yl]ethan-1-one |
| Molecular Weight: | 418.56 |
| Molecular Formula: | C24 H26 N4 O S |
| Smiles: | CC1=C(C(=NC(N1Cc1ccccc1)=S)N1CCN(CC1)c1ccccc1)C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6223 |
| logD: | 3.6223 |
| logSw: | -3.6568 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 30.5654 |
| InChI Key: | QRMUSYVMVJKJGX-UHFFFAOYSA-N |