N-(3-chloro-4-methylphenyl)-2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-carboxamide
N-(3-chloro-4-methylphenyl)-2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-carboxamide
Compound characteristics
| Compound ID: | K063-0052 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-carboxamide |
| Molecular Weight: | 397.85 |
| Molecular Formula: | C19 H24 Cl N O6 |
| Smiles: | Cc1ccc(cc1[Cl])NC(C1C2C(C3C(O1)OC(C)(C)O3)OC(C)(C)O2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9727 |
| logD: | 3.9722 |
| logSw: | -4.0552 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.175 |
| InChI Key: | ZZEXILUHBFSHFY-UHFFFAOYSA-N |