Formula |
C23H22N4O |
IUPAC Name |
7-cyclopentyl-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-amine |
Molecular Mass |
370.447 g·mol−1 |
Heat of Formation |
217.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.11 ± 1.08 D |
Volume |
445.6 Å 3 |
Surface Area |
390.09 Å 2 |
HOMO Energy |
-8.40 ± 0.55 eV |
LUMO Energy |
2.66 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 4-amino-5-(4-phenoxyphenyl)-7h-pyrrolo[3,2-d]pyrimidin-7-yl-cyclopentane
- 7-cyclopentyl-5-(4-phenoxyphenyl)-7h-pyrrolo[2,3‑d]pyrimidin-4-ylamine
- 7-cyclopentyl-5-[4-(phenoxy)phenyl]-4-pyrrolo[3,2-e]pyrimidinamine
- [7-cyclopentyl-5-[4-(phenoxy)phenyl]pyrrolo[3,2-e]pyrimidin-4-yl]amine
- lck inhibitor
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InChIKey |
FMETVQKSDIOGPX-UHFFFAOYSA-N |
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Links |
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Elements |
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