| Formula |
C27H32N6 |
| IUPAC Name |
6-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]-n-[(1s)-1-phenylethyl]-7h-pyrrolo[2,3-d]pyrimidine-1,3-diium-4a-id-4-amine |
| Molecular Mass |
440.583 g·mol−1 |
| Heat of Formation |
414.8 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.40 ± 1.08 D |
| Volume |
554.11 Å 3 |
| Surface Area |
486.27 Å 2 |
| HOMO Energy |
-8.29 ± 0.55 eV |
| LUMO Energy |
2.75 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 6-[4-[(4-ethyl-1-piperazinyl)methyl]phenyl]-n-[(1s)-1-phenylethyl]-7h-pyrrolo[3,2-e]pyrimidin-4-amine
- 6-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]-n-[(1s)-1-phenylethyl]-7h-pyrrolo[3,2-e]pyrimidin-4-amine
- [6-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]-7h-pyrrolo[3,2-e]pyrimidin-4-yl]-[(1s)-1-phenylethyl]amine
|
| InChIKey |
OONFNUWBHFSNBT-FQEVSTJZSA-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
N
|
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