ethyl 4-({6-[(4-chlorophenyl)methyl]-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({6-[(4-chlorophenyl)methyl]-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl}amino)benzoate
ethyl 4-({6-[(4-chlorophenyl)methyl]-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl}amino)benzoate
Compound characteristics
| Compound ID: | C102-0394 |
| Compound Name: | ethyl 4-({6-[(4-chlorophenyl)methyl]-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl}amino)benzoate |
| Molecular Weight: | 384.82 |
| Molecular Formula: | C19 H17 Cl N4 O3 |
| Smiles: | CCOC(c1ccc(cc1)NC1NC(C(Cc2ccc(cc2)[Cl])=NN=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4646 |
| logD: | 4.4614 |
| logSw: | -4.5458 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.509 |
| InChI Key: | YFVJAJWIEZAZBD-UHFFFAOYSA-N |