N-[rel-(1R,4R,5R)-2-(2H-1,3-benzodioxole-5-carbonyl)-2-azabicyclo[2.2.1]heptan-5-yl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[rel-(1R,4R,5R)-2-(2H-1,3-benzodioxole-5-carbonyl)-2-azabicyclo[2.2.1]heptan-5-yl]thiophene-2-carboxamide
N-[rel-(1R,4R,5R)-2-(2H-1,3-benzodioxole-5-carbonyl)-2-azabicyclo[2.2.1]heptan-5-yl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | S034-1831 |
| Compound Name: | N-[rel-(1R,4R,5R)-2-(2H-1,3-benzodioxole-5-carbonyl)-2-azabicyclo[2.2.1]heptan-5-yl]thiophene-2-carboxamide |
| Molecular Weight: | 370.43 |
| Molecular Formula: | C19 H18 N2 O4 S |
| Smiles: | C1[C@H]2CN(C(c3ccc4c(c3)OCO4)=O)[C@@H]1C[C@@H]2NC(c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.5136 |
| logD: | 2.5136 |
| logSw: | -2.9757 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.409 |
| InChI Key: | UELCCSJJMUPMAJ-IHRRRGAJSA-N |