(8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione
TL;DR: (8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione (CAS 78960-65-3) is a chemical compound with molecular formula C24H23N7O5 and molecular weight 489.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(2-hydroxy-1H-indol-3-yl)diazenyl]-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethylpurine-2,6-dione
Also Known As: (8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione, (E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-(2-(2-oxoindolin-3-ylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione, 7-(2-hydroxy-3-phenoxy-propyl)-1,3-dimethyl-8-[2-(2-oxoindol-3-yl)hydrazinyl]purine-2,6-dione, 7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione, 7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[2-(2-oxoindol-3-yl)hydrazinyl]purine-2,6-dione
| Molecular Formula | C24H23N7O5 |
|---|---|
| Molecular Weight | 489.18 g/mol |
| LogP | 2.4759 |
| Topological Polar Surface Area | 152.02 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 489.17606 |
| Heavy Atoms | 36 |
| Complexity | 1712.6047 |
Chemical Identifiers
| CAS Number | 78960-65-3 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N=NC3=C(NC4=CC=CC=C43)O)CC(COC5=CC=CC=C5)O |
Product Overview
(8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione (CAS 78960-65-3), with molecular formula C24H23N7O5 and molecular weight 489.18 g/mol. IUPAC: 8-[(2-hydroxy-1H-indol-3-yl)diazenyl]-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of (8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Property Insights of (8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione
The XLogP value of 2.4759 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione. The TPSA of 152.02 Ų indicates high polarity, suggesting (8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione?
The CAS number of (8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione is 78960-65-3.
What is the molecular formula of (8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione?
The molecular formula of (8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione is C24H23N7O5.
What is the molecular weight of (8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione?
The molecular weight of (8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione is 489.18 g/mol.
Where can I buy (8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione?
You can request a quote for (8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for (8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.