3-anilino-6-[(4-chlorophenyl)methyl]-1,2,4-triazin-5(4H)-one
Chemical Structure Depiction of
3-anilino-6-[(4-chlorophenyl)methyl]-1,2,4-triazin-5(4H)-one
3-anilino-6-[(4-chlorophenyl)methyl]-1,2,4-triazin-5(4H)-one
Compound characteristics
| Compound ID: | C102-0373 |
| Compound Name: | 3-anilino-6-[(4-chlorophenyl)methyl]-1,2,4-triazin-5(4H)-one |
| Molecular Weight: | 312.76 |
| Molecular Formula: | C16 H13 Cl N4 O |
| Smiles: | C(C1C(NC(Nc2ccccc2)=NN=1)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.6714 |
| logD: | 3.6712 |
| logSw: | -4.2438 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.756 |
| InChI Key: | GCRZOSSHBULBEN-UHFFFAOYSA-N |