N-(2-methoxydibenzo[b,d]furan-3-yl)-3-(1H-1,2,4-triazol-1-yl)adamantane-1-carboxamide
Chemical Structure Depiction of
N-(2-methoxydibenzo[b,d]furan-3-yl)-3-(1H-1,2,4-triazol-1-yl)adamantane-1-carboxamide
N-(2-methoxydibenzo[b,d]furan-3-yl)-3-(1H-1,2,4-triazol-1-yl)adamantane-1-carboxamide
Compound characteristics
| Compound ID: | Y508-7512 |
| Compound Name: | N-(2-methoxydibenzo[b,d]furan-3-yl)-3-(1H-1,2,4-triazol-1-yl)adamantane-1-carboxamide |
| Molecular Weight: | 442.52 |
| Molecular Formula: | C26 H26 N4 O3 |
| Smiles: | COc1cc2c3ccccc3oc2cc1NC(C12CC3CC(C1)CC(C3)(C2)n1cncn1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.4654 |
| logD: | 5.4639 |
| logSw: | -6.0595 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.698 |
| InChI Key: | HSHMIFYXZMMBDE-UHFFFAOYSA-N |