3-(3-chloroanilino)-6-methyl-1,2,4-triazin-5(4H)-one
Chemical Structure Depiction of
3-(3-chloroanilino)-6-methyl-1,2,4-triazin-5(4H)-one
3-(3-chloroanilino)-6-methyl-1,2,4-triazin-5(4H)-one
Compound characteristics
| Compound ID: | C102-0175 |
| Compound Name: | 3-(3-chloroanilino)-6-methyl-1,2,4-triazin-5(4H)-one |
| Molecular Weight: | 236.66 |
| Molecular Formula: | C10 H9 Cl N4 O |
| Smiles: | CC1C(NC(Nc2cccc(c2)[Cl])=NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5965 |
| logD: | 2.5813 |
| logSw: | -3.5036 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.297 |
| InChI Key: | PEOAWMHKZMKUPW-UHFFFAOYSA-N |