5-{[1-(4-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylidene}-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[1-(4-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylidene}-1,3-diazinane-2,4,6-trione
5-{[1-(4-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylidene}-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 8004-8412 |
| Compound Name: | 5-{[1-(4-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylidene}-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 346.73 |
| Molecular Formula: | C15 H11 Cl N4 O4 |
| Smiles: | Cc1c(C=C2C(NC(NC2=O)=O)=O)c(n(c2ccc(cc2)[Cl])n1)O |
| Stereo: | ACHIRAL |
| logP: | 0.8241 |
| logD: | -1.4282 |
| logSw: | -2.3639 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.493 |
| InChI Key: | KSZYNZLBHCJUCZ-UHFFFAOYSA-N |