| Formula |
C25H36Cl2N4O4 |
| IUPAC Name |
ethyl (1s,2s)-2-[4-[(2r)-2-(3-aminopropanoylamino)-3-(2,4-dichlorophenyl)propanoyl]piperazin-1-yl]cyclohexanecarboxylate |
| Molecular Mass |
527.484 g·mol−1 |
| Heat of Formation |
-820.0 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.13 ± 1.08 D |
| Volume |
619.9 Å 3 |
| Surface Area |
493.93 Å 2 |
| HOMO Energy |
-8.97 ± 0.55 eV |
| LUMO Energy |
-0.87 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (1s,2s)-2-[4-[(2r)-2-(3-aminopropanoylamino)-3-(2,4-dichlorophenyl)propanoyl]piperazin-1-yl]cyclohexane-1-carboxylic acid ethyl ester
- (1s,2s)-2-[4-[(2r)-2-[(3-amino-1-oxopropyl)amino]-3-(2,4-dichlorophenyl)-1-oxopropyl]-1-piperazinyl]-1-cyclohexanecarboxylic acid ethyl ester
- nbi-12i
|
| InChIKey |
BHZMEZUGBXLPOY-NNWRFLSQSA-N |
| QR Code |
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| Links |
PubChem
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|
| DOI |
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| Downloads |
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|
| Elements |
H
C
N
O
Cl
|
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