N-(3-chloro-4-methoxyphenyl)-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-methoxyphenyl)-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-methoxyphenyl)-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: | K063-0016 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-carboxamide |
| Molecular Weight: | 413.85 |
| Molecular Formula: | C19 H24 Cl N O7 |
| Smiles: | CC1(C)OC2C(C(Nc3ccc(c(c3)[Cl])OC)=O)OC3C(C2O1)OC(C)(C)O3 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0931 |
| logD: | 3.0923 |
| logSw: | -3.2832 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.805 |
| InChI Key: | HBNFQVOARRYRIC-UHFFFAOYSA-N |