1-(6-bromo-1H-indazol-3-yl)-N-[(oxan-4-yl)methyl]-5-oxopyrrolidine-3-carboxamide
Chemical Structure Depiction of
1-(6-bromo-1H-indazol-3-yl)-N-[(oxan-4-yl)methyl]-5-oxopyrrolidine-3-carboxamide
1-(6-bromo-1H-indazol-3-yl)-N-[(oxan-4-yl)methyl]-5-oxopyrrolidine-3-carboxamide
Compound characteristics
Compound ID: | J106-0720 |
Compound Name: | 1-(6-bromo-1H-indazol-3-yl)-N-[(oxan-4-yl)methyl]-5-oxopyrrolidine-3-carboxamide |
Molecular Weight: | 421.29 |
Molecular Formula: | C18 H21 Br N4 O3 |
Smiles: | C1COCCC1CNC(C1CC(N(C1)c1c2ccc(cc2[nH]n1)[Br])=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.3595 |
logD: | 2.3595 |
logSw: | -2.8722 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 71.912 |
InChI Key: | XKPHAXFCFXXGTM-GFCCVEGCSA-N |