5-({4-[(4-bromophenyl)methoxy]phenyl}methylidene)-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-({4-[(4-bromophenyl)methoxy]phenyl}methylidene)-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
5-({4-[(4-bromophenyl)methoxy]phenyl}methylidene)-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
Compound ID: | 3679-2254 |
Compound Name: | 5-({4-[(4-bromophenyl)methoxy]phenyl}methylidene)-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione |
Molecular Weight: | 445.33 |
Molecular Formula: | C20 H17 Br N2 O3 S |
Smiles: | CN1C(C(=Cc2ccc(cc2)OCc2ccc(cc2)[Br])C(N(C)C1=S)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.4111 |
logD: | 3.4111 |
logSw: | -3.6998 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 39.046 |
InChI Key: | FWYSLXUGIBQWNG-UHFFFAOYSA-N |