1-[4-(4-bromophenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-5-yl]ethan-1-one
Chemical Structure Depiction of
1-[4-(4-bromophenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-5-yl]ethan-1-one
1-[4-(4-bromophenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-5-yl]ethan-1-one
Compound characteristics
| Compound ID: | 8007-0808 |
| Compound Name: | 1-[4-(4-bromophenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-5-yl]ethan-1-one |
| Molecular Weight: | 325.22 |
| Molecular Formula: | C13 H13 Br N2 O S |
| Smiles: | CC1=C(C(c2ccc(cc2)[Br])NC(N1)=S)C(C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5289 |
| logD: | 2.5259 |
| logSw: | -2.9571 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 36.501 |
| InChI Key: | LHKBFVBCKFOSTM-LBPRGKRZSA-N |