N-(3,4-dimethylphenyl)-2-imino-6-nitro-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-2-imino-6-nitro-2H-1-benzopyran-3-carboxamide
N-(3,4-dimethylphenyl)-2-imino-6-nitro-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 8003-7271 |
| Compound Name: | N-(3,4-dimethylphenyl)-2-imino-6-nitro-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 337.33 |
| Molecular Formula: | C18 H15 N3 O4 |
| Smiles: | Cc1ccc(cc1C)NC(C1=Cc2cc(ccc2OC1=N)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6905 |
| logD: | 3.6901 |
| logSw: | -4.0439 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.949 |
| InChI Key: | MAOUUKHSGQQZMK-UHFFFAOYSA-N |