1-{4-[4-(3-chlorophenyl)piperazin-1-yl]-1-ethyl-6-methyl-2-sulfanylidene-1,2-dihydropyrimidin-5-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[4-(3-chlorophenyl)piperazin-1-yl]-1-ethyl-6-methyl-2-sulfanylidene-1,2-dihydropyrimidin-5-yl}ethan-1-one
1-{4-[4-(3-chlorophenyl)piperazin-1-yl]-1-ethyl-6-methyl-2-sulfanylidene-1,2-dihydropyrimidin-5-yl}ethan-1-one
Compound characteristics
| Compound ID: | 8015-1056 |
| Compound Name: | 1-{4-[4-(3-chlorophenyl)piperazin-1-yl]-1-ethyl-6-methyl-2-sulfanylidene-1,2-dihydropyrimidin-5-yl}ethan-1-one |
| Molecular Weight: | 390.93 |
| Molecular Formula: | C19 H23 Cl N4 O S |
| Smiles: | CCN1C(C)=C(C(=NC1=S)N1CCN(CC1)c1cccc(c1)[Cl])C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9039 |
| logD: | 2.9038 |
| logSw: | -3.3317 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 30.5617 |
| InChI Key: | VWOIIVKTNVBDQA-UHFFFAOYSA-N |