N-[rel-(1R,4R,5R)-2-(3-chloro-4-methylbenzene-1-sulfonyl)-2-azabicyclo[2.2.1]heptan-5-yl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[rel-(1R,4R,5R)-2-(3-chloro-4-methylbenzene-1-sulfonyl)-2-azabicyclo[2.2.1]heptan-5-yl]thiophene-2-carboxamide
N-[rel-(1R,4R,5R)-2-(3-chloro-4-methylbenzene-1-sulfonyl)-2-azabicyclo[2.2.1]heptan-5-yl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | S034-2135 |
| Compound Name: | N-[rel-(1R,4R,5R)-2-(3-chloro-4-methylbenzene-1-sulfonyl)-2-azabicyclo[2.2.1]heptan-5-yl]thiophene-2-carboxamide |
| Molecular Weight: | 410.94 |
| Molecular Formula: | C18 H19 Cl N2 O3 S2 |
| Smiles: | Cc1ccc(cc1[Cl])S(N1C[C@@H]2C[C@H]1C[C@@H]2NC(c1cccs1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.8207 |
| logD: | 3.8207 |
| logSw: | -4.2099 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.133 |
| InChI Key: | CXTWEWGYKMWKPG-HEHGZKQESA-N |