![8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE structure](/static/products/4773/477333-66-7.webp)
8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE
TL;DR: 8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE (CAS 477333-66-7) is a chemical compound with molecular formula C23H24N6O6 and molecular weight 480.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[benzyl(methyl)amino]-7-[2-hydroxy-3-(4-nitrophenoxy)propyl]-3-methylpurine-2,6-dione
Also Known As: 8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE, 8-(benzyl-methyl-amino)-7-[2-hydroxy-3-(4-nitrophenoxy)propyl]-3-methyl-purine-2,6-dione, 8-[benzyl(methyl)amino]-7-[2-hydroxy-3-(4-nitrophenoxy)propyl]-3-methylpurine-2,6-dione, 649-991-7, 8-(BENZYL(METHYL)AMINO)-7-(2-HYDROXY-3-(4-NITROPHENOXY)PROPYL)-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE
| Molecular Formula | C23H24N6O6 |
|---|---|
| Molecular Weight | 480.18 g/mol |
| LogP | 1.4078 |
| Topological Polar Surface Area | 148.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 480.17572 |
| Heavy Atoms | 35 |
| Complexity | 1458.3811 |
Chemical Identifiers
| CAS Number | 477333-66-7 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)N(C)CC3=CC=CC=C3)CC(COC4=CC=C(C=C4)[N+](=O)[O-])O |
Product Overview
8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE (CAS 477333-66-7), with molecular formula C23H24N6O6 and molecular weight 480.18 g/mol. IUPAC: 8-[benzyl(methyl)amino]-7-[2-hydroxy-3-(4-nitrophenoxy)propyl]-3-methylpurine-2,6-dione.
Chemical Property Profile of 8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE
Property Insights of 8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE
The XLogP value of 1.4078 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE. The TPSA of 148.52 Ų indicates high polarity, suggesting 8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE has 2 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 8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE?
The CAS number of 8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE is 477333-66-7.
What is the molecular formula of 8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE?
The molecular formula of 8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE is C23H24N6O6.
What is the molecular weight of 8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE?
The molecular weight of 8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE is 480.18 g/mol.
Where can I buy 8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE?
You can request a quote for 8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-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 8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE?
Yes, KEHONG BIO provides custom synthesis services for 8-[BENZYL(METHYL)AMINO]-7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.