N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-4-hydroxyphenyl]-3-methyl-4-nitrobenzamide
Chemical Structure Depiction of
N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-4-hydroxyphenyl]-3-methyl-4-nitrobenzamide
N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-4-hydroxyphenyl]-3-methyl-4-nitrobenzamide
Compound characteristics
| Compound ID: | 3763-0707 |
| Compound Name: | N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-4-hydroxyphenyl]-3-methyl-4-nitrobenzamide |
| Molecular Weight: | 417.42 |
| Molecular Formula: | C23 H19 N3 O5 |
| Smiles: | Cc1cc(C)c2c(c1)nc(c1cc(ccc1O)NC(c1ccc(c(C)c1)[N+]([O-])=O)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 6.0999 |
| logD: | 6.0995 |
| logSw: | -5.2602 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.002 |
| InChI Key: | PAIPPPXFINILAQ-UHFFFAOYSA-N |