5-({3-bromo-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxyphenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-({3-bromo-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxyphenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
5-({3-bromo-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxyphenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3202-0330 |
| Compound Name: | 5-({3-bromo-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxyphenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 533.44 |
| Molecular Formula: | C24 H25 Br N2 O5 S |
| Smiles: | CC(C)(C)c1ccc(cc1)OCCOc1c(cc(C=C2C(NC(NC2=O)=S)=O)cc1[Br])OC |
| Stereo: | ACHIRAL |
| logP: | 5.6984 |
| logD: | 5.2728 |
| logSw: | -5.4973 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.993 |
| InChI Key: | XRINARHYKWUPSK-UHFFFAOYSA-N |