N-acetyl-6,8-dichloro-2-[(3-fluorophenyl)imino]-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-acetyl-6,8-dichloro-2-[(3-fluorophenyl)imino]-2H-1-benzopyran-3-carboxamide
N-acetyl-6,8-dichloro-2-[(3-fluorophenyl)imino]-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 1319-0046 |
| Compound Name: | N-acetyl-6,8-dichloro-2-[(3-fluorophenyl)imino]-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 393.2 |
| Molecular Formula: | C18 H11 Cl2 F N2 O3 |
| Smiles: | CC(NC(C1=Cc2cc(cc(c2OC/1=N/c1cccc(c1)F)[Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5862 |
| logD: | 3.5493 |
| logSw: | -4.1283 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.07 |
| InChI Key: | NTIGBFJIYNTQKQ-UHFFFAOYSA-N |