5-{[1-(4-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-{[1-(4-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
5-{[1-(4-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 8004-8477 |
| Compound Name: | 5-{[1-(4-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 362.79 |
| Molecular Formula: | C15 H11 Cl N4 O3 S |
| Smiles: | Cc1c(C=C2C(NC(NC2=O)=S)=O)c(n(c2ccc(cc2)[Cl])n1)O |
| Stereo: | ACHIRAL |
| logP: | 1.9197 |
| logD: | -0.3326 |
| logSw: | -2.7462 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.476 |
| InChI Key: | HMEHPKGTMZGHRC-UHFFFAOYSA-N |