6-[(2-chlorophenyl)methyl]-3-(3-methoxyanilino)-1,2,4-triazin-5(4H)-one
Chemical Structure Depiction of
6-[(2-chlorophenyl)methyl]-3-(3-methoxyanilino)-1,2,4-triazin-5(4H)-one
6-[(2-chlorophenyl)methyl]-3-(3-methoxyanilino)-1,2,4-triazin-5(4H)-one
Compound characteristics
| Compound ID: | C102-0509 |
| Compound Name: | 6-[(2-chlorophenyl)methyl]-3-(3-methoxyanilino)-1,2,4-triazin-5(4H)-one |
| Molecular Weight: | 342.78 |
| Molecular Formula: | C17 H15 Cl N4 O2 |
| Smiles: | COc1cccc(c1)NC1NC(C(Cc2ccccc2[Cl])=NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.108 |
| logD: | 4.1074 |
| logSw: | -4.3937 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.3 |
| InChI Key: | BHPIQNNTIRFPGO-UHFFFAOYSA-N |