BAS 01107463
TL;DR: BAS 01107463 (CAS 303969-46-2) is a chemical compound with molecular formula C13H17N5O5S and molecular weight 355.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[7-(2-amino-2-oxoethyl)-3-methyl-2,6-dioxopurin-8-yl]sulfanylpropanoate
Also Known As: BAS 01107463, ethyl 2-{[7-(2-amino-2-oxoethyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}propanoate, ethyl 2-[7-(2-amino-2-oxoethyl)-3-methyl-2,6-dioxopurin-8-yl]sulfanylpropanoate, ethyl 2-[7-(carbamoylmethyl)-3-methyl-2,6-dioxo-1,3,7-trihydropurin-8-ylthio]p ropanoate, ethyl 2-((7-(2-amino-2-oxoethyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)propanoate
| Molecular Formula | C13H17N5O5S |
|---|---|
| Molecular Weight | 355.10 g/mol |
| LogP | -1.0477 |
| Topological Polar Surface Area | 142.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 355.09503 |
| Heavy Atoms | 24 |
| Complexity | 911.8388 |
Chemical Identifiers
| CAS Number | 303969-46-2 |
|---|---|
| SMILES | CCOC(=O)C(C)SC1=NC2=C(N1CC(=O)N)C(=O)NC(=O)N2C |
Product Overview
BAS 01107463 (CAS 303969-46-2), with molecular formula C13H17N5O5S and molecular weight 355.10 g/mol. IUPAC: ethyl 2-[7-(2-amino-2-oxoethyl)-3-methyl-2,6-dioxopurin-8-yl]sulfanylpropanoate.
Chemical Property Profile of BAS 01107463
Property Insights of BAS 01107463
The XLogP value of -1.0477 indicates that BAS 01107463 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 142.07 Ų indicates high polarity, suggesting BAS 01107463 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 01107463 has 2 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 01107463?
The CAS number of BAS 01107463 is 303969-46-2.
What is the molecular formula of BAS 01107463?
The molecular formula of BAS 01107463 is C13H17N5O5S.
What is the molecular weight of BAS 01107463?
The molecular weight of BAS 01107463 is 355.10 g/mol.
Where can I buy BAS 01107463?
You can request a quote for BAS 01107463 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01107463?
Yes, KEHONG BIO provides custom synthesis services for BAS 01107463 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.