2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Chemical Structure Depiction of
2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Compound characteristics
| Compound ID: | D549-2973 |
| Compound Name: | 2-{[5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide |
| Molecular Weight: | 472.59 |
| Molecular Formula: | C24 H20 N6 O S2 |
| Smiles: | C=CCn1c(c2c(c3cccnc3s2)N)nnc1SCC(Nc1cccc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0509 |
| logD: | 4.0493 |
| logSw: | -4.0844 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.938 |
| InChI Key: | DPPIOTILXXAKDU-UHFFFAOYSA-N |