Formula |
C29H25N5O2 |
IUPAC Name |
(3z)-5-[5-[(2s)-2-amino-3-(1h-indol-3-yl)propoxy]-3-pyridyl]-3-(1h-pyrrol-2-ylmethylene)indolin-2-one |
Molecular Mass |
475.541 g·mol−1 |
Heat of Formation |
255.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.34 ± 1.08 D |
Volume |
559.59 Å 3 |
Surface Area |
493.98 Å 2 |
HOMO Energy |
-8.55 ± 0.55 eV |
LUMO Energy |
-1.23 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (3z)-5-[5-[(2s)-2-amino-3-(1h-indol-3-yl)propoxy]-3-pyridyl]-3-(1h-pyrrol-2-ylmethylene)-2-indolinone
- (3z)-5-[5-[(2s)-2-amino-3-(1h-indol-3-yl)propoxy]-3-pyridyl]-3-(1h-pyrrol-2-ylmethylene)indolin-2-one
- (3z)-5-[5-[(2s)-2-amino-3-(1h-indol-3-yl)propoxy]-3-pyridyl]-3-(1h-pyrrol-2-ylmethylene)oxindole
- (3z)-5-[5-[(2s)-2-amino-3-(1h-indol-3-yl)propoxy]pyridin-3-yl]-3-(1h-pyrrol-2-ylmethylidene)-1h-indol-2-one
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InChIKey |
DQMKXCKXZQEVJU-VHLXNKDGSA-N |
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Links |
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Elements |
H
C
O
N
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