![6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione structure](/static/products/902/902026-45-3.png)
6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
TL;DR: 6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione (CAS 902026-45-3) is a chemical compound with molecular formula C25H26N4O6 and molecular weight 478.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione
Also Known As: 6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione, 6-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione, 6-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione
| Molecular Formula | C25H26N4O6 |
|---|---|
| Molecular Weight | 478.19 g/mol |
| LogP | 3.18222 |
| Topological Polar Surface Area | 110.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 478.18524 |
| Heavy Atoms | 35 |
| Complexity | 1577.8483 |
Chemical Identifiers
| CAS Number | 902026-45-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=C3C(=CN2CCC4=CC(=C(C=C4)OC)OC)N(C(=O)N(C3=O)C)C)[N+](=O)[O-] |
Product Overview
6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione (CAS 902026-45-3), with molecular formula C25H26N4O6 and molecular weight 478.19 g/mol. IUPAC: 6-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione.
Chemical Property Profile of 6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Property Insights of 6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
The XLogP value of 3.18222 indicates that 6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione. Following Lipinski's Rule of Five, 6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione has 0 hydrogen bond donor(s) and 6 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 6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione?
The CAS number of 6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione is 902026-45-3.
What is the molecular formula of 6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione?
The molecular formula of 6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione is C25H26N4O6.
What is the molecular weight of 6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione?
The molecular weight of 6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione is 478.19 g/mol.
Where can I buy 6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione?
You can request a quote for 6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-(3,4-dimethoxyphenethyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.