N-[rel-(1R,4R,6S)-2-(4-methoxy-2-methylbenzoyl)-2-azabicyclo[2.2.1]heptan-6-yl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[rel-(1R,4R,6S)-2-(4-methoxy-2-methylbenzoyl)-2-azabicyclo[2.2.1]heptan-6-yl]thiophene-2-carboxamide
N-[rel-(1R,4R,6S)-2-(4-methoxy-2-methylbenzoyl)-2-azabicyclo[2.2.1]heptan-6-yl]thiophene-2-carboxamide
Compound characteristics
Compound ID: | S032-1829 |
Compound Name: | N-[rel-(1R,4R,6S)-2-(4-methoxy-2-methylbenzoyl)-2-azabicyclo[2.2.1]heptan-6-yl]thiophene-2-carboxamide |
Molecular Weight: | 370.47 |
Molecular Formula: | C20 H22 N2 O3 S |
Smiles: | Cc1cc(ccc1C(N1C[C@@H]2C[C@@H]([C@H]1C2)NC(c1cccs1)=O)=O)OC |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 3.3649 |
logD: | 3.3649 |
logSw: | -3.662 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.661 |
InChI Key: | ULVXLSXJQCMTKI-XKQJLSEDSA-N |