C15H13N3O3S2
TL;DR: C15H13N3O3S2 (CAS 301847-46-1) is a chemical compound with molecular formula C15H13N3O3S2 and molecular weight 347.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-4-(3-methoxyphenyl)-2-methylsulfanylthieno[2,3-d]pyrimidine-6-carboxylic acid
Also Known As: 5-amino-4-(3-methoxyphenyl)-2-(methylthio)thieno[2,3-d]pyrimidine-6-carboxylic acid, 5-Amino-4-(3-methoxyphenyl)-2-(methylsulfanyl)thieno[2,3-d]pyrimidine-6-carboxylic acid, 5-amino-4-(3-methoxyphenyl)-2-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylic acid, 5-amino-4-(3-methoxyphenyl)-2-methylsulfanylthieno[2,3-d]pyrimidine-6-carboxylic acid, THIENO[2,3-D]PYRIMIDINE-6-CARBOXYLIC ACID,5-AMINO-4-(3-METHOXYPHENYL)-2-(METHYLTHIO)-(WXG01920)
| Molecular Formula | C15H13N3O3S2 |
|---|---|
| Molecular Weight | 347.04 g/mol |
| LogP | 3.3692 |
| Topological Polar Surface Area | 98.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 347.03983 |
| Heavy Atoms | 23 |
| Complexity | 908.36365 |
Chemical Identifiers
| CAS Number | 301847-46-1 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C2=C3C(=C(SC3=NC(=N2)SC)C(=O)O)N |
Product Overview
C15H13N3O3S2 (CAS 301847-46-1), with molecular formula C15H13N3O3S2 and molecular weight 347.04 g/mol. IUPAC: 5-amino-4-(3-methoxyphenyl)-2-methylsulfanylthieno[2,3-d]pyrimidine-6-carboxylic acid.
Chemical Property Profile of C15H13N3O3S2
Property Insights of C15H13N3O3S2
The XLogP value of 3.3692 indicates that C15H13N3O3S2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.33 Ų falls within the moderate polarity range, balancing permeability and solubility for C15H13N3O3S2. Following Lipinski's Rule of Five, C15H13N3O3S2 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 C15H13N3O3S2?
The CAS number of C15H13N3O3S2 is 301847-46-1.
What is the molecular formula of C15H13N3O3S2?
The molecular formula of C15H13N3O3S2 is C15H13N3O3S2.
What is the molecular weight of C15H13N3O3S2?
The molecular weight of C15H13N3O3S2 is 347.04 g/mol.
Where can I buy C15H13N3O3S2?
You can request a quote for C15H13N3O3S2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C15H13N3O3S2?
Yes, KEHONG BIO provides custom synthesis services for C15H13N3O3S2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.