Formula |
C22H23Cl2N3OS |
IUPAC Name |
(2z)-4-(3,4-dichlorophenyl)-2-[[2-(4-methylpiperazin-1-yl)phenyl]methylene]thiomorpholin-3-one |
Molecular Mass |
448.409 g·mol−1 |
Heat of Formation |
80.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.94 ± 1.08 D |
Volume |
501.34 Å 3 |
Surface Area |
385.68 Å 2 |
HOMO Energy |
-8.54 ± 0.55 eV |
LUMO Energy |
-0.62 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2z)-4-(3,4-dichlorophenyl)-2-[2-(4-methylpiperazin-1-yl)benzylidene]thiomorpholin-3-one
- (2z)-4-(3,4-dichlorophenyl)-2-[[2-(4-methyl-1-piperazinyl)phenyl]methylene]-3-thiomorpholinone
- (2z)-4-(3,4-dichlorophenyl)-2-[[2-(4-methylpiperazin-1-yl)phenyl]methylene]thiomorpholin-3-one
- (2z)-4-(3,4-dichlorophenyl)-2-[[2-(4-methylpiperazin-1-yl)phenyl]methylidene]thiomorpholin-3-one
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InChIKey |
LHYMPSWMHXUWSK-STZFKDTASA-N |
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Downloads |
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Elements |
C
Cl
H
O
N
S
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