6-{[(4-chlorophenyl)methyl]sulfanyl}-1,2,4-triazine-3,5(2H,4H)-dione
Chemical Structure Depiction of
6-{[(4-chlorophenyl)methyl]sulfanyl}-1,2,4-triazine-3,5(2H,4H)-dione
6-{[(4-chlorophenyl)methyl]sulfanyl}-1,2,4-triazine-3,5(2H,4H)-dione
Compound characteristics
| Compound ID: | 8010-2341 |
| Compound Name: | 6-{[(4-chlorophenyl)methyl]sulfanyl}-1,2,4-triazine-3,5(2H,4H)-dione |
| Molecular Weight: | 269.71 |
| Molecular Formula: | C10 H8 Cl N3 O2 S |
| Smiles: | C(c1ccc(cc1)[Cl])SC1C(NC(NN=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4217 |
| logD: | 1.4022 |
| logSw: | -2.7404 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.054 |
| InChI Key: | LGPVDMYMLAYVOM-UHFFFAOYSA-N |