1-(4-bromo-3-methylphenyl)-5-{[5-(morpholin-4-yl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
1-(4-bromo-3-methylphenyl)-5-{[5-(morpholin-4-yl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
1-(4-bromo-3-methylphenyl)-5-{[5-(morpholin-4-yl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
Compound characteristics
Compound ID: | 5609-0629 |
Compound Name: | 1-(4-bromo-3-methylphenyl)-5-{[5-(morpholin-4-yl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione |
Molecular Weight: | 460.28 |
Molecular Formula: | C20 H18 Br N3 O5 |
Smiles: | Cc1cc(ccc1[Br])N1C(C(=C\c2ccc(N3CCOCC3)o2)\C(NC1=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.8876 |
logD: | 2.808 |
logSw: | -3.1452 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 73.201 |
InChI Key: | NQAAXGMUSQMUBJ-UHFFFAOYSA-N |