5-({3-bromo-5-ethoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-({3-bromo-5-ethoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
5-({3-bromo-5-ethoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3202-0303 |
| Compound Name: | 5-({3-bromo-5-ethoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 505.39 |
| Molecular Formula: | C22 H21 Br N2 O5 S |
| Smiles: | CCOc1cc(C=C2C(NC(NC2=O)=S)=O)cc(c1OCCOc1ccccc1C)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.5897 |
| logD: | 4.1641 |
| logSw: | -4.4639 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.66 |
| InChI Key: | LDIAHJGQBINDSH-UHFFFAOYSA-N |