Formula |
C20H23FN2O4S2 |
IUPAC Name |
(2r)-2-(4-cyclopropylsulfonylphenyl)-n-(5-fluorothiazol-2-yl)-3-tetrahydropyran-4-yl-propanamide |
Molecular Mass |
438.536 g·mol−1 |
Heat of Formation |
-578.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.76 ± 1.08 D |
Volume |
501.55 Å 3 |
Surface Area |
409.49 Å 2 |
HOMO Energy |
-9.27 ± 0.55 eV |
LUMO Energy |
-0.98 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2r)-2-(4-cyclopropylsulfonylphenyl)-n-(5-fluoro-1,3-thiazol-2-yl)-3-(oxan-4-yl)propanamide
- (2r)-2-(4-cyclopropylsulfonylphenyl)-n-(5-fluoro-2-thiazolyl)-3-(4-tetrahydropyranyl)propanamide
- (2r)-2-(4-cyclopropylsulfonylphenyl)-n-(5-fluorothiazol-2-yl)-3-tetrahydropyran-4-yl-propanamide
- (2r)-2-(4-cyclopropylsulfonylphenyl)-n-(5-fluorothiazol-2-yl)-3-tetrahydropyran-4-yl-propionamide
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InChIKey |
DBMFNEZMJWKKPU-QGZVFWFLSA-N |
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Links |
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DOI |
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Downloads |
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Elements |
C
F
H
O
N
S
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