6-[(4-chlorophenyl)methyl]-3-(2-ethoxyanilino)-1,2,4-triazin-5(4H)-one
Chemical Structure Depiction of
6-[(4-chlorophenyl)methyl]-3-(2-ethoxyanilino)-1,2,4-triazin-5(4H)-one
6-[(4-chlorophenyl)methyl]-3-(2-ethoxyanilino)-1,2,4-triazin-5(4H)-one
Compound characteristics
| Compound ID: | C102-0387 |
| Compound Name: | 6-[(4-chlorophenyl)methyl]-3-(2-ethoxyanilino)-1,2,4-triazin-5(4H)-one |
| Molecular Weight: | 356.81 |
| Molecular Formula: | C18 H17 Cl N4 O2 |
| Smiles: | CCOc1ccccc1NC1NC(C(Cc2ccc(cc2)[Cl])=NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2727 |
| logD: | 4.271 |
| logSw: | -4.5237 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.268 |
| InChI Key: | ODILUYMYNQWQQX-UHFFFAOYSA-N |