![(4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone structure](/static/products/114/114460-85-4.png)
(4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone
TL;DR: (4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone (CAS 114460-85-4) is a chemical compound with molecular formula C14H11ClN4OS2 and molecular weight 350.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chlorophenyl)-(2,5-diamino-4-methylsulfanylthieno[2,3-d]pyrimidin-6-yl)methanone
Also Known As: ChemDiv3_014250, IDI1_030048, A3591/0152263, (4-chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone, (4-chlorophenyl)-(2,5-diamino-4-methylsulfanylthieno[2,3-d]pyrimidin-6-yl)methanone
| Molecular Formula | C14H11ClN4OS2 |
|---|---|
| Molecular Weight | 350.01 g/mol |
| LogP | 3.462 |
| Topological Polar Surface Area | 94.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 350.0063 |
| Heavy Atoms | 22 |
| Complexity | 876.67535 |
Chemical Identifiers
| CAS Number | 114460-85-4 |
|---|---|
| SMILES | CSC1=NC(=NC2=C1C(=C(S2)C(=O)C3=CC=C(C=C3)Cl)N)N |
Product Overview
(4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone (CAS 114460-85-4), with molecular formula C14H11ClN4OS2 and molecular weight 350.01 g/mol. IUPAC: (4-chlorophenyl)-(2,5-diamino-4-methylsulfanylthieno[2,3-d]pyrimidin-6-yl)methanone.
Chemical Property Profile of (4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone
Property Insights of (4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone
The XLogP value of 3.462 indicates that (4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.89 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone. Following Lipinski's Rule of Five, (4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone 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 (4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone?
The CAS number of (4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone is 114460-85-4.
What is the molecular formula of (4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone?
The molecular formula of (4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone is C14H11ClN4OS2.
What is the molecular weight of (4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone?
The molecular weight of (4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone is 350.01 g/mol.
Where can I buy (4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone?
You can request a quote for (4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-Chlorophenyl)(2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.