Formula |
C25H26ClN5O3 |
IUPAC Name |
(3e)-4-[[(2s)-2-(3-chlorophenyl)-2-hydroxyethyl]amino]-3-(4-methyl-6-morpholin-4-yl-1,3-dihydrobenzimidazol-2-ylidene)pyridin-2-one |
Molecular Mass |
479.959 g·mol−1 |
Heat of Formation |
-226.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
9.93 ± 1.08 D |
Volume |
536.27 Å 3 |
Surface Area |
398.16 Å 2 |
HOMO Energy |
-8.19 ± 0.55 eV |
LUMO Energy |
2.15 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (3e)-4-[[(2s)-2-(3-chlorophenyl)-2-hydroxy-ethyl]amino]-3-(4-methyl-6-morpholin-4-yl-1,3-dihydrobenzimidazol-2-ylidene)pyridin-2-one
- (3e)-4-[[(2s)-2-(3-chlorophenyl)-2-hydroxy-ethyl]amino]-3-(4-methyl-6-morpholino-1,3-dihydrobenzimidazol-2-ylidene)-2-pyridone
- (3e)-4-[[(2s)-2-(3-chlorophenyl)-2-hydroxy-ethyl]amino]-3-(4-methyl-6-morpholino-1,3-dihydrobenzimidazol-2-ylidene)pyridin-2-one
- (3e)-4-[[(2s)-2-(3-chlorophenyl)-2-hydroxyethyl]amino]-3-(4-methyl-6-morpholino-1,3-dihydrobenzimidazol-2-ylidene)-2-pyridinone
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InChIKey |
UGQMURPIMYALPH-PZJQAWQVSA-N |
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Links |
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Elements |
H
C
N
O
Cl
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