N-(4-chlorophenyl)-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-(4-chlorophenyl)-2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-carboxamide
N-(4-chlorophenyl)-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: | K063-0036 |
| Compound Name: | N-(4-chlorophenyl)-2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-carboxamide |
| Molecular Weight: | 383.83 |
| Molecular Formula: | C18 H22 Cl N O6 |
| Smiles: | CC1(C)OC2C(C(Nc3ccc(cc3)[Cl])=O)OC3C(C2O1)OC(C)(C)O3 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1772 |
| logD: | 3.1769 |
| logSw: | -3.3926 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.175 |
| InChI Key: | XINPLTKQOKCZLO-UHFFFAOYSA-N |