| Formula |
C22H23N5O3 |
| IUPAC Name |
6-[2-[(2,4-diamino-5-methyl-pyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxy-phenyl]hex-5-ynoic acid |
| Molecular Mass |
405.450 g·mol−1 |
| Heat of Formation |
-87.0 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.56 ± 1.08 D |
| Volume |
479.12 Å 3 |
| Surface Area |
420.93 Å 2 |
| HOMO Energy |
-8.60 ± 0.55 eV |
| LUMO Energy |
2.45 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 5-hexynoic acid, 6-[2-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenyl]-
|
| InChIKey |
MAWHZPJVFGJFTF-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
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| Downloads |
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|
| Elements |
H
C
O
N
|
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