1-(4-chlorophenyl)-5-{[1-(prop-2-yn-1-yl)-1H-indol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
1-(4-chlorophenyl)-5-{[1-(prop-2-yn-1-yl)-1H-indol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione
1-(4-chlorophenyl)-5-{[1-(prop-2-yn-1-yl)-1H-indol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 4724-2104 |
| Compound Name: | 1-(4-chlorophenyl)-5-{[1-(prop-2-yn-1-yl)-1H-indol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 403.82 |
| Molecular Formula: | C22 H14 Cl N3 O3 |
| Smiles: | C#CCn1cc(\C=C2/C(NC(N(C2=O)c2ccc(cc2)[Cl])=O)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.4327 |
| logD: | 2.8614 |
| logSw: | -3.8124 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.373 |
| InChI Key: | STQRRBMMTROHPD-UHFFFAOYSA-N |