5-{[4-bromo-5-(morpholin-4-yl)furan-2-yl]methylidene}-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-{[4-bromo-5-(morpholin-4-yl)furan-2-yl]methylidene}-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione
5-{[4-bromo-5-(morpholin-4-yl)furan-2-yl]methylidene}-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
Compound ID: | 3699-0361 |
Compound Name: | 5-{[4-bromo-5-(morpholin-4-yl)furan-2-yl]methylidene}-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione |
Molecular Weight: | 462.32 |
Molecular Formula: | C19 H16 Br N3 O4 S |
Smiles: | C1COCCN1c1c(cc(\C=C2/C(NC(N(C2=O)c2ccccc2)=S)=O)o1)[Br] |
Stereo: | ACHIRAL |
logP: | 2.4266 |
logD: | 2.0405 |
logSw: | -2.976 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.971 |
InChI Key: | RZRITOFOVQURNA-UHFFFAOYSA-N |