N-(3-{3-[(2-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-4-methoxyphenyl)-4-methyl-3-nitrobenzamide
Chemical Structure Depiction of
N-(3-{3-[(2-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-4-methoxyphenyl)-4-methyl-3-nitrobenzamide
N-(3-{3-[(2-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-4-methoxyphenyl)-4-methyl-3-nitrobenzamide
Compound characteristics
| Compound ID: | V028-6845 |
| Compound Name: | N-(3-{3-[(2-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-4-methoxyphenyl)-4-methyl-3-nitrobenzamide |
| Molecular Weight: | 492.51 |
| Molecular Formula: | C26 H25 F N4 O5 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(Nc1ccc(c(c1)N1CCCN(Cc2ccccc2F)C1=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0156 |
| logD: | 4.9978 |
| logSw: | -4.7274 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.298 |
| InChI Key: | ADLLUIVGABNNMW-UHFFFAOYSA-N |