| Formula |
C28H31ClN4O5S |
| IUPAC Name |
ethyl (2r,4s)-4-[(6-chloro-2-naphthyl)sulfonyl]-6-oxo-1-[[1-(4-pyridyl)-4-piperidyl]methyl]piperazine-2-carboxylate |
| Molecular Mass |
571.088 g·mol−1 |
| Heat of Formation |
-644.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.10 ± 1.08 D |
| Volume |
640.24 Å 3 |
| Surface Area |
493.56 Å 2 |
| HOMO Energy |
-8.72 ± 0.55 eV |
| LUMO Energy |
-1.88 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (2r)-4-[(6-chloro-2-naphthalenyl)sulfonyl]-6-oxo-1-[[1-(4-pyridinyl)-4-piperidinyl]methyl]-2-piperazinecarboxylic acid ethyl ester
- (2r)-4-[(6-chloro-2-naphthyl)sulfonyl]-6-keto-1-[[1-(4-pyridyl)-4-piperidyl]methyl]piperazine-2-carboxylic acid ethyl ester
- (2r)-4-[(6-chloro-2-naphthyl)sulfonyl]-6-oxo-1-[[1-(4-pyridyl)-4-piperidinyl]methyl]-2-piperazinecarboxylic acid ethyl ester
- ethyl (2r)-4-[(6-chloro-2-naphthyl)sulfonyl]-6-oxo-1-[[1-(4-pyridyl)-4-piperidyl]methyl]piperazine-2-carboxylate
- xmd
|
| InChIKey |
BVVKZWAFUVRXPJ-AREMUKBSSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
C
Cl
H
O
N
S
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