6-methyl-3-sulfanylidene-4-{[(3,4,5-trimethoxyphenyl)methylidene]amino}-3,4-dihydro-1,2,4-triazin-5(2H)-one
Chemical Structure Depiction of
6-methyl-3-sulfanylidene-4-{[(3,4,5-trimethoxyphenyl)methylidene]amino}-3,4-dihydro-1,2,4-triazin-5(2H)-one
6-methyl-3-sulfanylidene-4-{[(3,4,5-trimethoxyphenyl)methylidene]amino}-3,4-dihydro-1,2,4-triazin-5(2H)-one
Compound characteristics
| Compound ID: | 5069-0050 |
| Compound Name: | 6-methyl-3-sulfanylidene-4-{[(3,4,5-trimethoxyphenyl)methylidene]amino}-3,4-dihydro-1,2,4-triazin-5(2H)-one |
| Molecular Weight: | 336.37 |
| Molecular Formula: | C14 H16 N4 O4 S |
| Smiles: | CC1C(N(C(NN=1)=S)/N=C/c1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2094 |
| logD: | 0.9833 |
| logSw: | -2.1812 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.669 |
| InChI Key: | OUGFMJPFLVWXDP-UHFFFAOYSA-N |