(2,5-dimethylfuran-3-yl)[7-(3-fluorobenzene-1-sulfonyl)-9-oxa-3,7-diazabicyclo[3.3.1]nonan-3-yl]methanone
Chemical Structure Depiction of
(2,5-dimethylfuran-3-yl)[7-(3-fluorobenzene-1-sulfonyl)-9-oxa-3,7-diazabicyclo[3.3.1]nonan-3-yl]methanone
(2,5-dimethylfuran-3-yl)[7-(3-fluorobenzene-1-sulfonyl)-9-oxa-3,7-diazabicyclo[3.3.1]nonan-3-yl]methanone
Compound characteristics
Compound ID: | P217-0945 |
Compound Name: | (2,5-dimethylfuran-3-yl)[7-(3-fluorobenzene-1-sulfonyl)-9-oxa-3,7-diazabicyclo[3.3.1]nonan-3-yl]methanone |
Molecular Weight: | 408.45 |
Molecular Formula: | C19 H21 F N2 O5 S |
Smiles: | Cc1cc(C(N2CC3CN(CC(C2)O3)S(c2cccc(c2)F)(=O)=O)=O)c(C)o1 |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 1.8309 |
logD: | 1.8309 |
logSw: | -2.6658 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 62.355 |
InChI Key: | KWXPHPHSJCNARX-IYBDPMFKSA-N |