ethyl 5-(4-chlorophenyl)-3-(1-hydroxy-3-oxo-3,4-dihydro-1,2,4-benzotriazin-2(1H)-yl)-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
ethyl 5-(4-chlorophenyl)-3-(1-hydroxy-3-oxo-3,4-dihydro-1,2,4-benzotriazin-2(1H)-yl)-1H-pyrazole-4-carboxylate
ethyl 5-(4-chlorophenyl)-3-(1-hydroxy-3-oxo-3,4-dihydro-1,2,4-benzotriazin-2(1H)-yl)-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | C710-0137 |
| Compound Name: | ethyl 5-(4-chlorophenyl)-3-(1-hydroxy-3-oxo-3,4-dihydro-1,2,4-benzotriazin-2(1H)-yl)-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 413.82 |
| Molecular Formula: | C19 H16 Cl N5 O4 |
| Smiles: | CCOC(c1c(n[nH]c1c1ccc(cc1)[Cl])N1C(Nc2ccccc2N1O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6783 |
| logD: | 3.6233 |
| logSw: | -4.6226 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.562 |
| InChI Key: | TVFOYWLOLFOXLV-UHFFFAOYSA-N |