2-({5-[1-(4-bromoanilino)ethyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(naphthalen-1-yl)acetamide
Chemical Structure Depiction of
2-({5-[1-(4-bromoanilino)ethyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(naphthalen-1-yl)acetamide
2-({5-[1-(4-bromoanilino)ethyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(naphthalen-1-yl)acetamide
Compound characteristics
| Compound ID: | Y508-5272 |
| Compound Name: | 2-({5-[1-(4-bromoanilino)ethyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(naphthalen-1-yl)acetamide |
| Molecular Weight: | 558.5 |
| Molecular Formula: | C28 H24 Br N5 O S |
| Smiles: | CC(c1nnc(n1c1ccccc1)SCC(Nc1cccc2ccccc12)=O)Nc1ccc(cc1)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0367 |
| logD: | 6.0367 |
| logSw: | -6.6731 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.562 |
| InChI Key: | KXUDGMFZZUFSBB-IBGZPJMESA-N |