![5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione structure](/static/products/6938/693813-29-5.webp)
5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione
TL;DR: 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione (CAS 693813-29-5) is a chemical compound with molecular formula C21H18N4O5 and molecular weight 406.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione
Also Known As: 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione, 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione, 5-(4-METHOXYPHENYL)-1,3-DIMETHYL-6-(3-NITROPHENYL)-1H,2H,3H,4H,6H-PYRROLO[3,4-D]PYRIMIDINE-2,4-DIONE
| Molecular Formula | C21H18N4O5 |
|---|---|
| Molecular Weight | 406.13 g/mol |
| LogP | 2.6117 |
| Topological Polar Surface Area | 101.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 406.12772 |
| Heavy Atoms | 30 |
| Complexity | 1410.5939 |
Chemical Identifiers
| CAS Number | 693813-29-5 |
|---|---|
| SMILES | CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC=C(C=C3)OC)C4=CC(=CC=C4)[N+](=O)[O-] |
Product Overview
5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione (CAS 693813-29-5), with molecular formula C21H18N4O5 and molecular weight 406.13 g/mol. IUPAC: 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione.
Chemical Property Profile of 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione
Property Insights of 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione
The XLogP value of 2.6117 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione. The TPSA of 101.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione. Following Lipinski's Rule of Five, 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione has 0 hydrogen bond donor(s) and 5 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 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione?
The CAS number of 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione is 693813-29-5.
What is the molecular formula of 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione?
The molecular formula of 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione is C21H18N4O5.
What is the molecular weight of 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione?
The molecular weight of 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione is 406.13 g/mol.
Where can I buy 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione?
You can request a quote for 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-methoxyphenyl)-1,3-dimethyl-6-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.