![1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione structure](/static/products/879/879583-42-3.png)
1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione
TL;DR: 1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione (CAS 879583-42-3) is a chemical compound with molecular formula C21H22N4O2 and molecular weight 362.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-6-(2-phenylethyl)-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione
Also Known As: 1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione, 5-benzyl-9-phenethyl-3,5,7,9-tetrazabicyclo[4.4.0]dec-11-ene-2,4-dione, 1-benzyl-6-(2-phenylethyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 1-benzyl-6-phenethyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 1-benzyl-2-hydroxy-6-(2-phenylethyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
| Molecular Formula | C21H22N4O2 |
|---|---|
| Molecular Weight | 362.17 g/mol |
| LogP | 2.0126 |
| Topological Polar Surface Area | 70.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 362.1743 |
| Heavy Atoms | 27 |
| Complexity | 1025.5424 |
Chemical Identifiers
| CAS Number | 879583-42-3 |
|---|---|
| SMILES | C1C2=C(NCN1CCC3=CC=CC=C3)N(C(=O)NC2=O)CC4=CC=CC=C4 |
Product Overview
1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione (CAS 879583-42-3), with molecular formula C21H22N4O2 and molecular weight 362.17 g/mol. IUPAC: 1-benzyl-6-(2-phenylethyl)-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione.
Chemical Property Profile of 1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione
Property Insights of 1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione
The XLogP value of 2.0126 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione. The TPSA of 70.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione. Following Lipinski's Rule of Five, 1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione has 2 hydrogen bond donor(s) and 4 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 1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione?
The CAS number of 1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione is 879583-42-3.
What is the molecular formula of 1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione?
The molecular formula of 1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione is C21H22N4O2.
What is the molecular weight of 1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione?
The molecular weight of 1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione is 362.17 g/mol.
Where can I buy 1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione?
You can request a quote for 1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-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 1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-benzyl-6-phenethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.