Formula |
C25H21N5O3S2 |
IUPAC Name |
(5s)-5-[4-[(2s)-2-(1h-benzimidazol-2-yl)-2-(1,3-benzothiazol-2-ylamino)ethyl]phenyl]-1,1-dioxo-1,2-thiazolidin-3-one |
Molecular Mass |
503.596 g·mol−1 |
Heat of Formation |
-25.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.88 ± 1.08 D |
Volume |
553.32 Å 3 |
Surface Area |
474.4 Å 2 |
HOMO Energy |
-8.95 ± 0.55 eV |
LUMO Energy |
1.90 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (5s)-5-[4-[(2s)-2-(1h-benzimidazol-2-yl)-2-(1,3-benzothiazol-2-ylamino)ethyl]phenyl]-1,1-diketo-1,2-thiazolidin-3-one
- (5s)-5-[4-[(2s)-2-(1h-benzimidazol-2-yl)-2-(1,3-benzothiazol-2-ylamino)ethyl]phenyl]-1,1-dioxo-1,2-thiazolidin-3-one
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InChIKey |
CQVSNNWJZWEETM-UNMCSNQZSA-N |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
S
O
N
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