5-methyl-2-(4-nitrophenyl)-1,3-benzoxazole
Chemical Structure Depiction of
5-methyl-2-(4-nitrophenyl)-1,3-benzoxazole
5-methyl-2-(4-nitrophenyl)-1,3-benzoxazole
Compound characteristics
| Compound ID: | Y507-4464 |
| Compound Name: | 5-methyl-2-(4-nitrophenyl)-1,3-benzoxazole |
| Molecular Weight: | 254.24 |
| Molecular Formula: | C14 H10 N2 O3 |
| Smiles: | Cc1ccc2c(c1)nc(c1ccc(cc1)[N+]([O-])=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 3.8714 |
| logD: | 3.8714 |
| logSw: | -3.9659 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.43 |
| InChI Key: | OTMXSZCCSFYOKJ-UHFFFAOYSA-N |