| Formula |
C22H24N6O3 |
| IUPAC Name |
(2r)-n-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)pyrrolidine-2-carboxamide |
| Molecular Mass |
420.464 g·mol−1 |
| Heat of Formation |
-110.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
6.05 ± 1.08 D |
| Volume |
493.14 Å 3 |
| Surface Area |
420.13 Å 2 |
| HOMO Energy |
-8.75 ± 0.55 eV |
| LUMO Energy |
-0.86 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (2r)-n-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)pyrrolidine-2-carboxamide
- (2r)-n-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide
- (2r)-n-[2-(1,3-benzodioxol-5-yl)ethyl]-1-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-2-pyrrolidinecarboxamide
|
| InChIKey |
LBCGUKCXRVUULK-QGZVFWFLSA-N |
| QR Code |
Generate QR Code |
| Links |
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|
| DOI |
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| Downloads |
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|
| Elements |
H
C
O
N
|
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