1-(4-bromophenyl)-5-({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(4-bromophenyl)-5-({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
1-(4-bromophenyl)-5-({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3685-1941 |
| Compound Name: | 1-(4-bromophenyl)-5-({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 475.36 |
| Molecular Formula: | C21 H19 Br N2 O4 S |
| Smiles: | CC(C)Oc1ccc(\C=C2/C(NC(N(C2=O)c2ccc(cc2)[Br])=S)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.9666 |
| logD: | 3.5916 |
| logSw: | -4.1702 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.748 |
| InChI Key: | XNBIGKJBZYIMOK-UHFFFAOYSA-N |