6-tert-butyl-3-(3-methoxyanilino)-1,2,4-triazin-5(4H)-one
Chemical Structure Depiction of
6-tert-butyl-3-(3-methoxyanilino)-1,2,4-triazin-5(4H)-one
6-tert-butyl-3-(3-methoxyanilino)-1,2,4-triazin-5(4H)-one
Compound characteristics
| Compound ID: | C102-0199 |
| Compound Name: | 6-tert-butyl-3-(3-methoxyanilino)-1,2,4-triazin-5(4H)-one |
| Molecular Weight: | 274.32 |
| Molecular Formula: | C14 H18 N4 O2 |
| Smiles: | CC(C)(C)C1C(NC(Nc2cccc(c2)OC)=NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2403 |
| logD: | 3.2392 |
| logSw: | -3.5534 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.668 |
| InChI Key: | UAMXBJJMXMZBAK-UHFFFAOYSA-N |