![3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one structure](/static/products/3156/315684-46-9.webp)
3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one
TL;DR: 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one (CAS 315684-46-9) is a chemical compound with molecular formula C17H19N3OS and molecular weight 313.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4-one
Also Known As: AB00113895-01, AF-399/15128486, 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one, 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4-one, 3-Amino-5-[4-(1,1-dimethylethyl)phenyl]-2-methylthieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C17H19N3OS |
|---|---|
| Molecular Weight | 313.12 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 86.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 313.12488 |
| Heavy Atoms | 22 |
| Complexity | 477.0 |
Chemical Identifiers
| CAS Number | 315684-46-9 |
|---|---|
| SMILES | CC1=NC2=C(C(=CS2)C3=CC=C(C=C3)C(C)(C)C)C(=O)N1N |
| InChIKey | KCDMQOOYDRHPBF-UHFFFAOYSA-N |
Product Overview
3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one (CAS 315684-46-9), with molecular formula C17H19N3OS and molecular weight 313.12 g/mol. IUPAC: 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4-one.
Chemical Property Profile of 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one
Property Insights of 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one
The XLogP value of 3.4 indicates that 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one. Following Lipinski's Rule of Five, 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one has 1 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 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one?
The CAS number of 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one is 315684-46-9.
What is the molecular formula of 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one?
The molecular formula of 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one is C17H19N3OS.
What is the molecular weight of 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one?
The molecular weight of 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one is 313.12 g/mol.
Where can I buy 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one?
You can request a quote for 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-amino-5-(4-tert-butylphenyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.