[5-(benzylamino)-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](4-methoxyphenyl)methanone
Chemical Structure Depiction of
[5-(benzylamino)-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](4-methoxyphenyl)methanone
[5-(benzylamino)-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](4-methoxyphenyl)methanone
Compound characteristics
| Compound ID: | D116-0271 |
| Compound Name: | [5-(benzylamino)-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](4-methoxyphenyl)methanone |
| Molecular Weight: | 385.42 |
| Molecular Formula: | C22 H19 N5 O2 |
| Smiles: | COc1ccc(cc1)C(n1c(NCc2ccccc2)nc(c2cccnc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9887 |
| logD: | 2.8393 |
| logSw: | -3.0857 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.289 |
| InChI Key: | SPFNFTSNGCNHBN-UHFFFAOYSA-N |