N-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-2-chloro-N-(propan-2-yl)benzamide
Chemical Structure Depiction of
N-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-2-chloro-N-(propan-2-yl)benzamide
N-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-2-chloro-N-(propan-2-yl)benzamide
Compound characteristics
| Compound ID: | V029-2593 |
| Compound Name: | N-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-2-chloro-N-(propan-2-yl)benzamide |
| Molecular Weight: | 413.86 |
| Molecular Formula: | C21 H20 Cl N3 O4 |
| Salt: | not_available |
| Smiles: | CC(C)N(CCc1nc(c2ccc3c(c2)OCO3)no1)C(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8983 |
| logD: | 4.8983 |
| logSw: | -4.8366 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.63 |
| InChI Key: | CTWFPMQTZLZZLR-UHFFFAOYSA-N |