Formula |
C19H25Cl2N3O3 |
IUPAC Name |
methyl (3r)-4-[2-(3,4-dichlorophenyl)acetyl]-3-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylate |
Molecular Mass |
414.326 g·mol−1 |
Heat of Formation |
-524.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.59 ± 1.08 D |
Volume |
477.92 Å 3 |
Surface Area |
401.86 Å 2 |
HOMO Energy |
-9.11 ± 0.55 eV |
LUMO Energy |
-0.49 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (3r)-4-[2-(3,4-dichlorophenyl)-1-oxoethyl]-3-(1-pyrrolidinylmethyl)-1-piperazinecarboxylic acid methyl ester
- (3r)-4-[2-(3,4-dichlorophenyl)acetyl]-3-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylic acid methyl ester
- methyl (3r)-4-[2-(3,4-dichlorophenyl)acetyl]-3-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylate
- methyl (3r)-4-[2-(3,4-dichlorophenyl)ethanoyl]-3-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylate
- tocris-1483
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InChIKey |
HJUAKZYKCANOOZ-OAHLLOKOSA-N |
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Links |
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Downloads |
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Elements |
H
C
N
O
Cl
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