![9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione structure](/static/products/121/121511-74-8.png)
9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione
TL;DR: 9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione (CAS 121511-74-8) is a chemical compound with molecular formula C16H15N5O3 and molecular weight 325.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-benzyl-1-methyl-6,7-dihydropurino[7,8-a]pyrimidine-2,4,8-trione
Also Known As: BAS 00340074, 9-benzyl-1-methyl-6,7-dihydropurino[7,8-a]pyrimidine-2,4,8-trione, 1-methyl-9-(phenylmethyl)-6,7-dihydropyrimido[2,1-f]purine-2,4,8(1H,3H,9H)-trione, 1-methyl-9-benzyl-1,3,5,6,7,9-hexahydropyrimidino[1,2-h]purine-2,4,8-trione, 8-Benzyl-1-methyl-5,6-dihydro-1H,8H-1,3,4b,8,9-pentaaza-fluorene-2,4,7-trione
| Molecular Formula | C16H15N5O3 |
|---|---|
| Molecular Weight | 325.12 g/mol |
| LogP | 0.3602 |
| Topological Polar Surface Area | 92.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 325.1175 |
| Heavy Atoms | 24 |
| Complexity | 1060.9918 |
Chemical Identifiers
| CAS Number | 121511-74-8 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N3CCC(=O)N(C3=N2)CC4=CC=CC=C4 |
Product Overview
9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione (CAS 121511-74-8), with molecular formula C16H15N5O3 and molecular weight 325.12 g/mol. IUPAC: 9-benzyl-1-methyl-6,7-dihydropurino[7,8-a]pyrimidine-2,4,8-trione.
Chemical Property Profile of 9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione
Property Insights of 9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione
The XLogP value of 0.3602 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione. The TPSA of 92.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione. Following Lipinski's Rule of Five, 9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione has 1 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 9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione?
The CAS number of 9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione is 121511-74-8.
What is the molecular formula of 9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione?
The molecular formula of 9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione is C16H15N5O3.
What is the molecular weight of 9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione?
The molecular weight of 9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione is 325.12 g/mol.
Where can I buy 9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione?
You can request a quote for 9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 9-benzyl-4-hydroxy-1-methyl-6,7-dihydropyrimido[2,1-f]purine-2,8(1H,9H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.