![3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid structure](/static/products/899/899381-40-9.png)
3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid
TL;DR: 3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid (CAS 899381-40-9) is a chemical compound with molecular formula C14H11N3O2S and molecular weight 285.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid
Also Known As: 3-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid, 3-((6-methylthieno[2,3-d]pyrimidin-4-yl)amino)benzoic acid, 3-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid hydrochloride, 3-[(8-methyl-7-thia-3,5-diazabicyclo[4.3.0]nona-1,3,5,8-tetraen-2-yl)amino]benzoic Acid
| Molecular Formula | C14H11N3O2S |
|---|---|
| Molecular Weight | 285.06 g/mol |
| LogP | 3.44152 |
| Topological Polar Surface Area | 75.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 285.0572 |
| Heavy Atoms | 20 |
| Complexity | 797.96826 |
Chemical Identifiers
| CAS Number | 899381-40-9 |
|---|---|
| SMILES | CC1=CC2=C(N=CN=C2S1)NC3=CC=CC(=C3)C(=O)O |
Product Overview
3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid (CAS 899381-40-9), with molecular formula C14H11N3O2S and molecular weight 285.06 g/mol. IUPAC: 3-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid.
Chemical Property Profile of 3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid
Property Insights of 3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid
The XLogP value of 3.44152 indicates that 3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid. Following Lipinski's Rule of Five, 3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid 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 3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid?
The CAS number of 3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid is 899381-40-9.
What is the molecular formula of 3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid?
The molecular formula of 3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid is C14H11N3O2S.
What is the molecular weight of 3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid?
The molecular weight of 3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid is 285.06 g/mol.
Where can I buy 3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid?
You can request a quote for 3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.