6,8-di-tert-butyl-3-(6-methyl-1H-benzimidazol-2-yl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6,8-di-tert-butyl-3-(6-methyl-1H-benzimidazol-2-yl)-2H-1-benzopyran-2-one
6,8-di-tert-butyl-3-(6-methyl-1H-benzimidazol-2-yl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K026-0149 |
| Compound Name: | 6,8-di-tert-butyl-3-(6-methyl-1H-benzimidazol-2-yl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 388.51 |
| Molecular Formula: | C25 H28 N2 O2 |
| Smiles: | Cc1ccc2c(c1)[nH]c(C1=Cc3cc(cc(c3OC1=O)C(C)(C)C)C(C)(C)C)n2 |
| Stereo: | ACHIRAL |
| logP: | 7.0366 |
| logD: | 7.0365 |
| logSw: | -5.7264 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.864 |
| InChI Key: | YDVYMHKGPFSKQT-UHFFFAOYSA-N |