5-({5-chloro-2-[2-(4-methylphenoxy)ethoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-({5-chloro-2-[2-(4-methylphenoxy)ethoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
5-({5-chloro-2-[2-(4-methylphenoxy)ethoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
Compound ID: | 3202-0364 |
Compound Name: | 5-({5-chloro-2-[2-(4-methylphenoxy)ethoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione |
Molecular Weight: | 416.88 |
Molecular Formula: | C20 H17 Cl N2 O4 S |
Smiles: | Cc1ccc(cc1)OCCOc1ccc(cc1C=C1C(NC(NC1=O)=S)=O)[Cl] |
Stereo: | ACHIRAL |
logP: | 4.6619 |
logD: | 4.4003 |
logSw: | -4.6882 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 64.276 |
InChI Key: | WZQICSWNGCEJJN-UHFFFAOYSA-N |