| Formula |
C19H22ClN5 |
| IUPAC Name |
[4-[(4-chlorophenyl)methyl]-1-(7h-pyrrolo[2,3-d]pyrimidin-4-yl)-4-piperidyl]methanamine |
| Molecular Mass |
355.864 g·mol−1 |
| Heat of Formation |
260.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.34 ± 1.08 D |
| Volume |
420.12 Å 3 |
| Surface Area |
356.99 Å 2 |
| HOMO Energy |
-8.45 ± 0.55 eV |
| LUMO Energy |
-0.31 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- [4-(4-chlorobenzyl)-1-(7h-pyrrolo[3,2-e]pyrimidin-4-yl)-4-piperidyl]methylamine
- [4-[(4-chlorophenyl)methyl]-1-(7h-pyrrolo[3,2-e]pyrimidin-4-yl)-4-piperidinyl]methanamine
- [4-[(4-chlorophenyl)methyl]-1-(7h-pyrrolo[3,2-e]pyrimidin-4-yl)-4-piperidyl]methanamine
|
| InChIKey |
KCWPSUKJCKZEAO-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
Cl
N
|
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