1-(3-fluorophenyl)-5-{[1-(prop-2-yn-1-yl)-1H-indol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
1-(3-fluorophenyl)-5-{[1-(prop-2-yn-1-yl)-1H-indol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione
1-(3-fluorophenyl)-5-{[1-(prop-2-yn-1-yl)-1H-indol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione
Compound characteristics
Compound ID: | 4281-2053 |
Compound Name: | 1-(3-fluorophenyl)-5-{[1-(prop-2-yn-1-yl)-1H-indol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione |
Molecular Weight: | 387.37 |
Molecular Formula: | C22 H14 F N3 O3 |
Smiles: | C#CCn1cc(\C=C2/C(NC(N(C2=O)c2cccc(c2)F)=O)=O)c2ccccc12 |
Stereo: | ACHIRAL |
logP: | 2.9134 |
logD: | 1.5204 |
logSw: | -3.2313 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.373 |
InChI Key: | QEJXIKADAHTSFS-UHFFFAOYSA-N |