4-[({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methylidene)amino]-6-methyl-3-sulfanylidene-3,4-dihydro-1,2,4-triazin-5(2H)-one
Chemical Structure Depiction of
4-[({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methylidene)amino]-6-methyl-3-sulfanylidene-3,4-dihydro-1,2,4-triazin-5(2H)-one
4-[({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methylidene)amino]-6-methyl-3-sulfanylidene-3,4-dihydro-1,2,4-triazin-5(2H)-one
Compound characteristics
| Compound ID: | 6404-0124 |
| Compound Name: | 4-[({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methylidene)amino]-6-methyl-3-sulfanylidene-3,4-dihydro-1,2,4-triazin-5(2H)-one |
| Molecular Weight: | 334.39 |
| Molecular Formula: | C15 H18 N4 O3 S |
| Smiles: | CC(C)Oc1ccc(/C=N/N2C(C(C)=NNC2=S)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.8156 |
| logD: | 1.6937 |
| logSw: | -2.5341 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.211 |
| InChI Key: | NEEQCQRXNOEINO-UHFFFAOYSA-N |