BAS 07401571
TL;DR: BAS 07401571 (CAS 501352-37-0) is a chemical compound with molecular formula C20H22N6O3S and molecular weight 426.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[2-(1,3-benzoxazol-2-ylsulfanyl)ethyl]-1,3-dimethyl-8-pyrrolidin-1-ylpurine-2,6-dione
Also Known As: BAS 07401571, 7-(2-(benzo[d]oxazol-2-ylthio)ethyl)-1,3-dimethyl-8-(pyrrolidin-1-yl)-1H-purine-2,6(3H,7H)-dione, AB00668529-01, F0570-0310, 7-[2-(1,3-benzoxazol-2-ylsulfanyl)ethyl]-1,3-dimethyl-8-pyrrolidin-1-ylpurine-2,6-dione
| Molecular Formula | C20H22N6O3S |
|---|---|
| Molecular Weight | 426.15 g/mol |
| LogP | 1.9674 |
| Topological Polar Surface Area | 91.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 426.1474 |
| Heavy Atoms | 30 |
| Complexity | 1325.8733 |
Chemical Identifiers
| CAS Number | 501352-37-0 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCC3)CCSC4=NC5=CC=CC=C5O4 |
Product Overview
BAS 07401571 (CAS 501352-37-0), with molecular formula C20H22N6O3S and molecular weight 426.15 g/mol. IUPAC: 7-[2-(1,3-benzoxazol-2-ylsulfanyl)ethyl]-1,3-dimethyl-8-pyrrolidin-1-ylpurine-2,6-dione.
Chemical Property Profile of BAS 07401571
Property Insights of BAS 07401571
The XLogP value of 1.9674 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07401571. The TPSA of 91.09 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07401571. Following Lipinski's Rule of Five, BAS 07401571 has 0 hydrogen bond donor(s) and 7 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 07401571?
The CAS number of BAS 07401571 is 501352-37-0.
What is the molecular formula of BAS 07401571?
The molecular formula of BAS 07401571 is C20H22N6O3S.
What is the molecular weight of BAS 07401571?
The molecular weight of BAS 07401571 is 426.15 g/mol.
Where can I buy BAS 07401571?
You can request a quote for BAS 07401571 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07401571?
Yes, KEHONG BIO provides custom synthesis services for BAS 07401571 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.