5-({3-bromo-5-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-({3-bromo-5-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
5-({3-bromo-5-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3620-0813 |
| Compound Name: | 5-({3-bromo-5-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 397.24 |
| Molecular Formula: | C15 H13 Br N2 O4 S |
| Smiles: | COc1cc(C=C2C(NC(NC2=O)=S)=O)cc(c1OCC=C)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.1357 |
| logD: | 2.7101 |
| logSw: | -3.4295 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.847 |
| InChI Key: | MBZPGKGFZFBGFX-UHFFFAOYSA-N |