IWP 12
TL;DR: IWP 12 (CAS 688353-45-9) is a chemical compound with molecular formula C18H18N4O2S3 and molecular weight 418.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,6-dimethyl-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
Also Known As: IWP 12, IWP12, EX-A14595, AB00409379-05, 2-[(3,6-dimethyl-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
| Molecular Formula | C18H18N4O2S3 |
|---|---|
| Molecular Weight | 418.06 g/mol |
| LogP | 3.46592 |
| Topological Polar Surface Area | 76.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 418.0592 |
| Heavy Atoms | 27 |
| Complexity | 1105.9152 |
Chemical Identifiers
| CAS Number | 688353-45-9 |
|---|---|
| SMILES | CC1CC2=C(S1)C(=O)N(C(=N2)SCC(=O)NC3=NC4=C(S3)C=C(C=C4)C)C |
Product Overview
IWP 12 (CAS 688353-45-9), with molecular formula C18H18N4O2S3 and molecular weight 418.06 g/mol. IUPAC: 2-[(3,6-dimethyl-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide.
Chemical Property Profile of IWP 12
Property Insights of IWP 12
The XLogP value of 3.46592 indicates that IWP 12 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.88 Ų falls within the moderate polarity range, balancing permeability and solubility for IWP 12. Following Lipinski's Rule of Five, IWP 12 has 1 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 IWP 12?
The CAS number of IWP 12 is 688353-45-9.
What is the molecular formula of IWP 12?
The molecular formula of IWP 12 is C18H18N4O2S3.
What is the molecular weight of IWP 12?
The molecular weight of IWP 12 is 418.06 g/mol.
Where can I buy IWP 12?
You can request a quote for IWP 12 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IWP 12?
Yes, KEHONG BIO provides custom synthesis services for IWP 12 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.