2-imino-N-[(4-methylphenyl)methyl]-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
2-imino-N-[(4-methylphenyl)methyl]-2H-1-benzopyran-3-carboxamide
2-imino-N-[(4-methylphenyl)methyl]-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | Y200-6576 |
| Compound Name: | 2-imino-N-[(4-methylphenyl)methyl]-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 292.34 |
| Molecular Formula: | C18 H16 N2 O2 |
| Smiles: | Cc1ccc(CNC(C2=Cc3ccccc3OC2=N)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.7306 |
| logD: | 2.7305 |
| logSw: | -3.2351 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.89 |
| InChI Key: | XBNHLLNGRIMHCW-UHFFFAOYSA-N |