4-methyl-3-nitro-N-{4-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}benzamide
Chemical Structure Depiction of
4-methyl-3-nitro-N-{4-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}benzamide
4-methyl-3-nitro-N-{4-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}benzamide
Compound characteristics
| Compound ID: | 4244-1217 |
| Compound Name: | 4-methyl-3-nitro-N-{4-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}benzamide |
| Molecular Weight: | 415.45 |
| Molecular Formula: | C24 H21 N3 O4 |
| Smiles: | CC(C)c1ccc2c(c1)nc(c1ccc(cc1)NC(c1ccc(C)c(c1)[N+]([O-])=O)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 5.9677 |
| logD: | 5.9672 |
| logSw: | -5.5162 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.22 |
| InChI Key: | GKCCIUGRENDEJI-UHFFFAOYSA-N |