1-(4-bromophenyl)-5-{[5-(morpholin-4-yl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(4-bromophenyl)-5-{[5-(morpholin-4-yl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
1-(4-bromophenyl)-5-{[5-(morpholin-4-yl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
Compound ID: | 4490-0933 |
Compound Name: | 1-(4-bromophenyl)-5-{[5-(morpholin-4-yl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione |
Molecular Weight: | 462.32 |
Molecular Formula: | C19 H16 Br N3 O4 S |
Smiles: | C1COCCN1c1ccc(\C=C2/C(NC(N(C2=O)c2ccc(cc2)[Br])=S)=O)o1 |
Stereo: | ACHIRAL |
logP: | 2.8295 |
logD: | 2.4433 |
logSw: | -3.3594 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.039 |
InChI Key: | DNZDKMDEVPIXMB-UHFFFAOYSA-N |