3-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]aniline
Chemical Structure Depiction of
3-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]aniline
3-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]aniline
Compound characteristics
| Compound ID: | 4269-3079 |
| Compound Name: | 3-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]aniline |
| Molecular Weight: | 252.31 |
| Molecular Formula: | C16 H16 N2 O |
| Smiles: | CC(C)c1ccc2c(c1)nc(c1cccc(c1)N)o2 |
| Stereo: | ACHIRAL |
| logP: | 3.7616 |
| logD: | 3.7612 |
| logSw: | -4.0695 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 37.855 |
| InChI Key: | ZTQHZYKIBXKILV-UHFFFAOYSA-N |