N-{rel-(3R,4S)-1-benzyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}-1H-indazole-3-carboxamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-1-benzyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}-1H-indazole-3-carboxamide
N-{rel-(3R,4S)-1-benzyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}-1H-indazole-3-carboxamide
Compound characteristics
Compound ID: | S639-9228 |
Compound Name: | N-{rel-(3R,4S)-1-benzyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}-1H-indazole-3-carboxamide |
Molecular Weight: | 377.49 |
Molecular Formula: | C22 H27 N5 O |
Smiles: | CN(C)C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(c1c2ccccc2[nH]n1)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 2.1898 |
logD: | 0.1231 |
logSw: | -2.6705 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 55.674 |
InChI Key: | WLRPQBPAWFNCRQ-PXNSSMCTSA-N |