4'-chloro-5-[(1H-1,2,4-triazol-5-yl)amino]-1,6-dihydro[1,1'-biphenyl]-3(2H)-one
Chemical Structure Depiction of
4'-chloro-5-[(1H-1,2,4-triazol-5-yl)amino]-1,6-dihydro[1,1'-biphenyl]-3(2H)-one
4'-chloro-5-[(1H-1,2,4-triazol-5-yl)amino]-1,6-dihydro[1,1'-biphenyl]-3(2H)-one
Compound characteristics
| Compound ID: | Y020-1848 |
| Compound Name: | 4'-chloro-5-[(1H-1,2,4-triazol-5-yl)amino]-1,6-dihydro[1,1'-biphenyl]-3(2H)-one |
| Molecular Weight: | 288.73 |
| Molecular Formula: | C14 H13 Cl N4 O |
| Smiles: | C1C(CC(C=C1Nc1ncn[nH]1)=O)c1ccc(cc1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4793 |
| logD: | 1.4502 |
| logSw: | -3.457 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.832 |
| InChI Key: | BPRDVFOCQQWQNQ-SNVBAGLBSA-N |