5-{[5-(2-bromo-4-methylphenyl)furan-2-yl]methylidene}-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-{[5-(2-bromo-4-methylphenyl)furan-2-yl]methylidene}-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
5-{[5-(2-bromo-4-methylphenyl)furan-2-yl]methylidene}-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
Compound ID: | 3679-2162 |
Compound Name: | 5-{[5-(2-bromo-4-methylphenyl)furan-2-yl]methylidene}-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione |
Molecular Weight: | 419.29 |
Molecular Formula: | C18 H15 Br N2 O3 S |
Smiles: | Cc1ccc(c(c1)[Br])c1ccc(C=C2C(N(C)C(N(C)C2=O)=S)=O)o1 |
Stereo: | ACHIRAL |
logP: | 3.3415 |
logD: | 3.3415 |
logSw: | -3.6132 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 39.388 |
InChI Key: | BJMSXWYPGYIAPW-UHFFFAOYSA-N |