N-(4-methoxyphenyl)-2-nitro-2-(5-nitro-1,3-dihydro-2H-benzimidazol-2-ylidene)acetamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-2-nitro-2-(5-nitro-1,3-dihydro-2H-benzimidazol-2-ylidene)acetamide
N-(4-methoxyphenyl)-2-nitro-2-(5-nitro-1,3-dihydro-2H-benzimidazol-2-ylidene)acetamide
Compound characteristics
| Compound ID: | 4872-0521 |
| Compound Name: | N-(4-methoxyphenyl)-2-nitro-2-(5-nitro-1,3-dihydro-2H-benzimidazol-2-ylidene)acetamide |
| Molecular Weight: | 371.31 |
| Molecular Formula: | C16 H13 N5 O6 |
| Smiles: | COc1ccc(cc1)NC(\C(=C1/Nc2ccc(cc2N1)[N+]([O-])=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8933 |
| logD: | 2.7753 |
| logSw: | -3.6567 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 119.132 |
| InChI Key: | FLTIGPFQGYLBQF-UHFFFAOYSA-N |