4-tert-butyl-2,6-bis[(1-methyl-1H-pyrrol-2-yl)methylidene]cyclohexan-1-one
Chemical Structure Depiction of
4-tert-butyl-2,6-bis[(1-methyl-1H-pyrrol-2-yl)methylidene]cyclohexan-1-one
4-tert-butyl-2,6-bis[(1-methyl-1H-pyrrol-2-yl)methylidene]cyclohexan-1-one
Compound characteristics
| Compound ID: | C151-0652 |
| Compound Name: | 4-tert-butyl-2,6-bis[(1-methyl-1H-pyrrol-2-yl)methylidene]cyclohexan-1-one |
| Molecular Weight: | 336.48 |
| Molecular Formula: | C22 H28 N2 O |
| Smiles: | CC(C)(C)C1C/C(=C\c2cccn2C)C(C(\C1)=C\c1cccn1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8914 |
| logD: | 5.8914 |
| logSw: | -5.4823 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 18.8294 |
| InChI Key: | KMWDDFMSYYVYDH-UHFFFAOYSA-N |