N-[2-(3,4-dimethoxyphenyl)ethyl]-1',3',5'-trimethyl-1'H,2H-[3,4'-bipyrazole]-5-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-1',3',5'-trimethyl-1'H,2H-[3,4'-bipyrazole]-5-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-1',3',5'-trimethyl-1'H,2H-[3,4'-bipyrazole]-5-carboxamide
Compound characteristics
| Compound ID: | Y041-6112 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-1',3',5'-trimethyl-1'H,2H-[3,4'-bipyrazole]-5-carboxamide |
| Molecular Weight: | 383.45 |
| Molecular Formula: | C20 H25 N5 O3 |
| Smiles: | Cc1c(c2cc(C(NCCc3ccc(c(c3)OC)OC)=O)n[nH]2)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.0327 |
| logD: | 1.0326 |
| logSw: | -2.1282 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.083 |
| InChI Key: | VSZFFOFSPYBZJT-UHFFFAOYSA-N |