| Formula |
C21H21N5O |
| IUPAC Name |
2-[[2-[(3r)-3-amino-1-piperidyl]-4-oxo-quinazolin-3-yl]methyl]benzonitrile |
| Molecular Mass |
359.424 g·mol−1 |
| Heat of Formation |
207.8 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.56 ± 1.08 D |
| Volume |
432.98 Å 3 |
| Surface Area |
351.41 Å 2 |
| HOMO Energy |
-9.03 ± 0.55 eV |
| LUMO Energy |
2.16 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2-[[2-[(3r)-3-amino-1-piperidinyl]-4-oxo-3-quinazolinyl]methyl]benzonitrile
- 2-[[2-[(3r)-3-amino-1-piperidyl]-4-keto-quinazolin-3-yl]methyl]benzonitrile
- 2-[[2-[(3r)-3-amino-1-piperidyl]-4-oxo-quinazolin-3-yl]methyl]benzonitrile
- 2-[[2-[(3r)-3-aminopiperidin-1-yl]-4-oxo-quinazolin-3-yl]methyl]benzonitrile
|
| InChIKey |
OYNURZXTLNNKAP-QGZVFWFLSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
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|
| DOI |
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| Downloads |
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|
| Elements |
H
C
O
N
|
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