| Formula |
C18H18ClN5O4S |
| IUPAC Name |
(2s,3r)-2-amino-n-[3-(4-amino-2-chloro-quinazolin-7-yl)phenyl]sulfonyl-3-hydroxy-butanamide |
| Molecular Mass |
435.885 g·mol−1 |
| Heat of Formation |
-438.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
6.78 ± 1.08 D |
| Volume |
466.5 Å 3 |
| Surface Area |
402.19 Å 2 |
| HOMO Energy |
-9.21 ± 0.55 eV |
| LUMO Energy |
-1.24 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
MSFGWBJSNPMREF-PSLIRLAXSA-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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