Formula |
C20H22ClN3O3S |
IUPAC Name |
n-[2-[2-[(4-chlorophenyl)methoxy]ethylamino]ethyl]isoquinoline-5-sulfonamide |
Molecular Mass |
419.925 g·mol−1 |
Heat of Formation |
-223.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.12 ± 1.08 D |
Volume |
485.2 Å 3 |
Surface Area |
405.79 Å 2 |
HOMO Energy |
-9.33 ± 0.55 eV |
LUMO Energy |
-1.31 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- isoquinoline-5-sulfonic acid (2-(2-(4-chlorobenzyloxy)ethylamino)ethyl)amide
- n-[2-[2-[(4-chlorophenyl)methoxy]ethylamino]ethyl]-5-isoquinolinesulfonamide
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InChIKey |
AUHWQSZMVMMRLM-UHFFFAOYSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
C
Cl
H
O
N
S
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