BAS 12521353
TL;DR: BAS 12521353 (CAS 876151-17-6) is a chemical compound with molecular formula C20H23N5O2 and molecular weight 365.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-9-(2-phenylethyl)-3-prop-2-enyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
Also Known As: BAS 12521353, 3-allyl-1-methyl-9-phenethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione, F2013-0269, 1-methyl-9-(2-phenylethyl)-3-prop-2-enyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione, 1-methyl-9-phenethyl-3-prop-2-enyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
| Molecular Formula | C20H23N5O2 |
|---|---|
| Molecular Weight | 365.19 g/mol |
| LogP | 1.5355 |
| Topological Polar Surface Area | 65.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 365.18518 |
| Heavy Atoms | 27 |
| Complexity | 1107.333 |
Chemical Identifiers
| CAS Number | 876151-17-6 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)CC=C)N3CCCN(C3=N2)CCC4=CC=CC=C4 |
Product Overview
BAS 12521353 (CAS 876151-17-6), with molecular formula C20H23N5O2 and molecular weight 365.19 g/mol. IUPAC: 1-methyl-9-(2-phenylethyl)-3-prop-2-enyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione.
Chemical Property Profile of BAS 12521353
Property Insights of BAS 12521353
The XLogP value of 1.5355 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12521353. The TPSA of 65.06 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12521353. Following Lipinski's Rule of Five, BAS 12521353 has 0 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 BAS 12521353?
The CAS number of BAS 12521353 is 876151-17-6.
What is the molecular formula of BAS 12521353?
The molecular formula of BAS 12521353 is C20H23N5O2.
What is the molecular weight of BAS 12521353?
The molecular weight of BAS 12521353 is 365.19 g/mol.
Where can I buy BAS 12521353?
You can request a quote for BAS 12521353 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12521353?
Yes, KEHONG BIO provides custom synthesis services for BAS 12521353 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.