6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione
TL;DR: 6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione (CAS 6044-27-5) is a chemical compound with molecular formula C18H17N3O3 and molecular weight 323.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Also Known As: 6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione, 8-benzyl-2-(2-furyl)-5-methyl-3,5,8-triazabicyclo[4.3.0]non-10-ene-4,9-dione, 6-Benzyl-4-(furan-2-yl)-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
| Molecular Formula | C18H17N3O3 |
|---|---|
| Molecular Weight | 323.13 g/mol |
| LogP | 2.2722 |
| Topological Polar Surface Area | 65.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.12698 |
| Heavy Atoms | 24 |
| Complexity | 811.29926 |
Chemical Identifiers
| CAS Number | 6044-27-5 |
|---|---|
| SMILES | CN1C2=C(C(NC1=O)C3=CC=CO3)C(=O)N(C2)CC4=CC=CC=C4 |
Product Overview
6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione (CAS 6044-27-5), with molecular formula C18H17N3O3 and molecular weight 323.13 g/mol. IUPAC: 6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione.
Chemical Property Profile of 6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Property Insights of 6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione
The XLogP value of 2.2722 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione. The TPSA of 65.79 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione. Following Lipinski's Rule of Five, 6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione has 1 hydrogen bond donor(s) and 3 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-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione?
The CAS number of 6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione is 6044-27-5.
What is the molecular formula of 6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione?
The molecular formula of 6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione is C18H17N3O3.
What is the molecular weight of 6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione?
The molecular weight of 6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione is 323.13 g/mol.
Where can I buy 6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione?
You can request a quote for 6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-benzyl-4-(furan-2-yl)-1-methyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.