BAS 00286850
TL;DR: BAS 00286850 (CAS 77350-99-3) is a chemical compound with molecular formula C16H17N5O3 and molecular weight 327.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-hydroxy-1-methyl-9-(4-methylphenyl)-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
Also Known As: BAS 00286850, VU0488186-1, 7-hydroxy-1-methyl-9-(p-tolyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione, 7-hydroxy-1-methyl-9-(4-methylphenyl)-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione, 7-hydroxy-1-methyl-9-(4-methylphenyl)-1H,2H,3H,4H,6H,7H,8H,9H-pyrimido[1,2-g]purine-2,4-dione
| Molecular Formula | C16H17N5O3 |
|---|---|
| Molecular Weight | 327.13 g/mol |
| LogP | 0.24432 |
| Topological Polar Surface Area | 96.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 327.13315 |
| Heavy Atoms | 24 |
| Complexity | 1044.4906 |
Chemical Identifiers
| CAS Number | 77350-99-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2CC(CN3C2=NC4=C3C(=O)NC(=O)N4C)O |
Product Overview
BAS 00286850 (CAS 77350-99-3), with molecular formula C16H17N5O3 and molecular weight 327.13 g/mol. IUPAC: 7-hydroxy-1-methyl-9-(4-methylphenyl)-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione.
Chemical Property Profile of BAS 00286850
Property Insights of BAS 00286850
The XLogP value of 0.24432 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00286850. The TPSA of 96.15 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00286850. Following Lipinski's Rule of Five, BAS 00286850 has 2 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 BAS 00286850?
The CAS number of BAS 00286850 is 77350-99-3.
What is the molecular formula of BAS 00286850?
The molecular formula of BAS 00286850 is C16H17N5O3.
What is the molecular weight of BAS 00286850?
The molecular weight of BAS 00286850 is 327.13 g/mol.
Where can I buy BAS 00286850?
You can request a quote for BAS 00286850 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00286850?
Yes, KEHONG BIO provides custom synthesis services for BAS 00286850 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.