| Formula |
C19H20ClN3O4S |
| IUPAC Name |
(2r)-2-(3-chloro-4-methylsulfonyl-phenyl)-3-[(1r)-3-oxocyclopentyl]-n-pyrazine-1,4-diium-2-yl-propanamide |
| Molecular Mass |
421.898 g·mol−1 |
| Heat of Formation |
-514.6 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.27 ± 1.08 D |
| Volume |
462.34 Å 3 |
| Surface Area |
399.25 Å 2 |
| HOMO Energy |
-9.77 ± 0.55 eV |
| LUMO Energy |
-1.44 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (2r)-2-(3-chloro-4-mesyl-phenyl)-3-[(1r)-3-ketocyclopentyl]-n-pyrazin-2-yl-propionamide
- (2r)-2-(3-chloro-4-methylsulfonyl-phenyl)-3-[(1r)-3-oxocyclopentyl]-n-pyrazin-2-yl-propanamide
- (2r)-2-(3-chloro-4-methylsulfonylphenyl)-3-[(1r)-3-oxocyclopentyl]-n-(2-pyrazinyl)propanamide
- (2r)-2-(3-chloro-4-methylsulfonylphenyl)-3-[(1r)-3-oxocyclopentyl]-n-pyrazin-2-ylpropanamide
|
| InChIKey |
XEANIURBPHCHMG-SWLSCSKDSA-N |
| QR Code |
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| Links |
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|
| DOI |
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| Downloads |
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|
| Elements |
C
Cl
H
O
N
S
|
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