(furan-2-yl)[3-(pyridin-3-yl)-5-{[(thiophen-2-yl)methyl]amino}-1H-1,2,4-triazol-1-yl]methanone
Chemical Structure Depiction of
(furan-2-yl)[3-(pyridin-3-yl)-5-{[(thiophen-2-yl)methyl]amino}-1H-1,2,4-triazol-1-yl]methanone
(furan-2-yl)[3-(pyridin-3-yl)-5-{[(thiophen-2-yl)methyl]amino}-1H-1,2,4-triazol-1-yl]methanone
Compound characteristics
| Compound ID: | D116-0199 |
| Compound Name: | (furan-2-yl)[3-(pyridin-3-yl)-5-{[(thiophen-2-yl)methyl]amino}-1H-1,2,4-triazol-1-yl]methanone |
| Molecular Weight: | 351.38 |
| Molecular Formula: | C17 H13 N5 O2 S |
| Smiles: | C(c1cccs1)Nc1nc(c2cccnc2)nn1C(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1504 |
| logD: | 2.001 |
| logSw: | -2.1468 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.342 |
| InChI Key: | UIVODEQLCGBHPQ-UHFFFAOYSA-N |