3-(2H-1,3-benzodioxol-5-yl)-N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine
3-(2H-1,3-benzodioxol-5-yl)-N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine
Compound characteristics
| Compound ID: | 1688-0272 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine |
| Molecular Weight: | 424.5 |
| Molecular Formula: | C27 H24 N2 O3 |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nc2cc(ccc2o1)/N=C/C=C/c1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 7.0568 |
| logD: | 7.0568 |
| logSw: | -5.8766 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.923 |
| InChI Key: | VNDYLDBDHQIQJO-UHFFFAOYSA-N |