N-benzyl-1-(4-chlorobenzoyl)-1-methyl-2-oxo-1,7b-dihydrocyclopropa[c][1]benzopyran-1a(2H)-carboxamide
Chemical Structure Depiction of
N-benzyl-1-(4-chlorobenzoyl)-1-methyl-2-oxo-1,7b-dihydrocyclopropa[c][1]benzopyran-1a(2H)-carboxamide
N-benzyl-1-(4-chlorobenzoyl)-1-methyl-2-oxo-1,7b-dihydrocyclopropa[c][1]benzopyran-1a(2H)-carboxamide
Compound characteristics
| Compound ID: | 8016-1718 |
| Compound Name: | N-benzyl-1-(4-chlorobenzoyl)-1-methyl-2-oxo-1,7b-dihydrocyclopropa[c][1]benzopyran-1a(2H)-carboxamide |
| Molecular Weight: | 445.9 |
| Molecular Formula: | C26 H20 Cl N O4 |
| Smiles: | CC1(C2c3ccccc3OC(C12C(NCc1ccccc1)=O)=O)C(c1ccc(cc1)[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1367 |
| logD: | 5.1351 |
| logSw: | -5.7484 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.292 |
| InChI Key: | NKVOCSCXBJQULQ-UHFFFAOYSA-N |