| Formula |
C23H32N6O5S |
| IUPAC Name |
5-[2-ethoxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-phenyl]-1-methyl-3-propyl-4h-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Mass |
504.602 g·mol−1 |
| Heat of Formation |
-515.1 ± 16.7 kJ·mol−1 |
| Dipole Moment |
10.75 ± 1.08 D |
| Volume |
586.16 Å 3 |
| Surface Area |
487.53 Å 2 |
| HOMO Energy |
-8.82 ± 0.55 eV |
| LUMO Energy |
1.95 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 5-[2-ethoxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-phenyl]-1-methyl-3-propyl-4h-pyrazolo[5,4-e]pyrimidin-7-one
- 5-[2-ethoxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonylphenyl]-1-methyl-3-propyl-4h-pyrazolo[5,4-e]pyrimidin-7-one
- 5-[2-ethoxy-5-[[4-(2-hydroxyethyl)-1-piperazinyl]sulfonyl]phenyl]-1-methyl-3-propyl-4h-pyrazolo[5,4-e]pyrimidin-7-one
|
| InChIKey |
NEYKRKVLEWKOBI-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
Wikipedia
ChemSpider
|
| DOI |
|
| Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
| Elements |
H
S
C
O
N
|
| |
|
