(4-tert-butylphenyl)[5-{[(3-chlorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]methanone
Chemical Structure Depiction of
(4-tert-butylphenyl)[5-{[(3-chlorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]methanone
(4-tert-butylphenyl)[5-{[(3-chlorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]methanone
Compound characteristics
| Compound ID: | D331-0545 |
| Compound Name: | (4-tert-butylphenyl)[5-{[(3-chlorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]methanone |
| Molecular Weight: | 434.92 |
| Molecular Formula: | C24 H23 Cl N4 O2 |
| Smiles: | CC(C)(C)c1ccc(cc1)C(n1c(NCc2cccc(c2)[Cl])nc(c2ccco2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9282 |
| logD: | 5.9282 |
| logSw: | -6.1409 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.806 |
| InChI Key: | MFQQBIIRWGYQHR-UHFFFAOYSA-N |