5-({5-bromo-2-[(4-methylphenyl)methoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-({5-bromo-2-[(4-methylphenyl)methoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
5-({5-bromo-2-[(4-methylphenyl)methoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3714-0274 |
| Compound Name: | 5-({5-bromo-2-[(4-methylphenyl)methoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 431.31 |
| Molecular Formula: | C19 H15 Br N2 O3 S |
| Smiles: | Cc1ccc(COc2ccc(cc2C=C2C(NC(NC2=O)=S)=O)[Br])cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8026 |
| logD: | 4.541 |
| logSw: | -4.8274 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.94 |
| InChI Key: | VIRHVFDNLXRWPA-UHFFFAOYSA-N |