N-acetyl-2-[(naphthalen-1-yl)imino]-6-nitro-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-acetyl-2-[(naphthalen-1-yl)imino]-6-nitro-2H-1-benzopyran-3-carboxamide
N-acetyl-2-[(naphthalen-1-yl)imino]-6-nitro-2H-1-benzopyran-3-carboxamide
Compound characteristics
Compound ID: | 2432-4508 |
Compound Name: | N-acetyl-2-[(naphthalen-1-yl)imino]-6-nitro-2H-1-benzopyran-3-carboxamide |
Molecular Weight: | 401.38 |
Molecular Formula: | C22 H15 N3 O5 |
Smiles: | CC(NC(C1=Cc2cc(ccc2OC/1=N/c1cccc2ccccc12)[N+]([O-])=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.2607 |
logD: | 3.2238 |
logSw: | -3.7888 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 85.798 |
InChI Key: | XVLXPJKZMZOZFK-UHFFFAOYSA-N |