5-{[4-(benzyloxy)-3-bromophenyl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-{[4-(benzyloxy)-3-bromophenyl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
5-{[4-(benzyloxy)-3-bromophenyl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 4058-0063 |
| Compound Name: | 5-{[4-(benzyloxy)-3-bromophenyl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 417.28 |
| Molecular Formula: | C18 H13 Br N2 O3 S |
| Smiles: | C(c1ccccc1)Oc1ccc(C=C2C(NC(NC2=O)=S)=O)cc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.8954 |
| logD: | 3.4698 |
| logSw: | -4.2535 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.94 |
| InChI Key: | PQLFQXNYRICORF-UHFFFAOYSA-N |