| Formula |
C20H22N4O3S |
| IUPAC Name |
4-[[2-[[(1r,2r)-2-hydroxycyclohexyl]amino]-1,3-benzothiazol-6-yl]oxy]-n-methyl-pyridine-2-carboxamide |
| Molecular Mass |
398.479 g·mol−1 |
| Heat of Formation |
-248.7 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.05 ± 1.08 D |
| Volume |
454.85 Å 3 |
| Surface Area |
410.23 Å 2 |
| HOMO Energy |
-8.60 ± 0.55 eV |
| LUMO Energy |
-1.14 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
ADZBMFGQQWPHMJ-RHSMWYFYSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
H
S
C
O
N
|
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