N-[rel-(1R,5S)-8-(2,5-difluorobenzoyl)-8-azabicyclo[3.2.1]octan-3-yl]-5-methylpyrazine-2-carboxamide
Chemical Structure Depiction of
N-[rel-(1R,5S)-8-(2,5-difluorobenzoyl)-8-azabicyclo[3.2.1]octan-3-yl]-5-methylpyrazine-2-carboxamide
N-[rel-(1R,5S)-8-(2,5-difluorobenzoyl)-8-azabicyclo[3.2.1]octan-3-yl]-5-methylpyrazine-2-carboxamide
Compound characteristics
Compound ID: | T651-0135 |
Compound Name: | N-[rel-(1R,5S)-8-(2,5-difluorobenzoyl)-8-azabicyclo[3.2.1]octan-3-yl]-5-methylpyrazine-2-carboxamide |
Molecular Weight: | 386.4 |
Molecular Formula: | C20 H20 F2 N4 O2 |
Smiles: | Cc1cnc(cn1)C(NC1C[C@@H]2CC[C@H](C1)N2C(c1cc(ccc1F)F)=O)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 1.4511 |
logD: | 1.4511 |
logSw: | -2.0937 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.786 |
InChI Key: | CNUHLSAKSHROJC-GOOCMWNKSA-N |