(4-tert-butylphenyl)[3-(furan-2-yl)-5-{[(4-methoxyphenyl)methyl]amino}-1H-1,2,4-triazol-1-yl]methanone
Chemical Structure Depiction of
(4-tert-butylphenyl)[3-(furan-2-yl)-5-{[(4-methoxyphenyl)methyl]amino}-1H-1,2,4-triazol-1-yl]methanone
(4-tert-butylphenyl)[3-(furan-2-yl)-5-{[(4-methoxyphenyl)methyl]amino}-1H-1,2,4-triazol-1-yl]methanone
Compound characteristics
| Compound ID: | D116-0106 |
| Compound Name: | (4-tert-butylphenyl)[3-(furan-2-yl)-5-{[(4-methoxyphenyl)methyl]amino}-1H-1,2,4-triazol-1-yl]methanone |
| Molecular Weight: | 430.51 |
| Molecular Formula: | C25 H26 N4 O3 |
| Smiles: | CC(C)(C)c1ccc(cc1)C(n1c(NCc2ccc(cc2)OC)nc(c2ccco2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2132 |
| logD: | 5.2132 |
| logSw: | -5.1236 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.349 |
| InChI Key: | PODQHCAGGBSDNH-UHFFFAOYSA-N |