5-({2-bromo-5-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-({2-bromo-5-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
5-({2-bromo-5-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3684-0161 |
| Compound Name: | 5-({2-bromo-5-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 425.3 |
| Molecular Formula: | C17 H17 Br N2 O4 S |
| Smiles: | CN1C(C(=Cc2cc(c(cc2[Br])OCC=C)OC)C(N(C)C1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6956 |
| logD: | 1.6956 |
| logSw: | -2.1473 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 46.953 |
| InChI Key: | NTRGMRGEHKYRRR-UHFFFAOYSA-N |