N-(3,5-dichloro-4-hydroxyphenyl)-1-[(5-phenyl-2H-tetrazol-2-yl)methyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(3,5-dichloro-4-hydroxyphenyl)-1-[(5-phenyl-2H-tetrazol-2-yl)methyl]-1H-pyrazole-3-carboxamide
N-(3,5-dichloro-4-hydroxyphenyl)-1-[(5-phenyl-2H-tetrazol-2-yl)methyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y508-5031 |
| Compound Name: | N-(3,5-dichloro-4-hydroxyphenyl)-1-[(5-phenyl-2H-tetrazol-2-yl)methyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 430.25 |
| Molecular Formula: | C18 H13 Cl2 N7 O2 |
| Smiles: | C(n1ccc(C(Nc2cc(c(c(c2)[Cl])O)[Cl])=O)n1)n1nc(c2ccccc2)nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.0758 |
| logD: | 3.897 |
| logSw: | -4.1405 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.994 |
| InChI Key: | NAXFNKFTBCAHFP-UHFFFAOYSA-N |