Formula |
C26H37N3O5S |
IUPAC Name |
n-butyl-3-[4-(ethoxymethyl)-2,6-dimethoxy-phenyl]-6-methoxy-n-tetrahydropyran-4-yl-pyrazolo[5,1-b]thiazol-7-amine |
Molecular Mass |
503.654 g·mol−1 |
Heat of Formation |
-512.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.48 ± 1.08 D |
Volume |
610.72 Å 3 |
Surface Area |
508.01 Å 2 |
HOMO Energy |
-7.42 ± 0.55 eV |
LUMO Energy |
-0.56 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
MKMSLJYQGXJIQH-UHFFFAOYSA-N |
QR Code |
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Elements |
H
S
C
O
N
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