AB00686963-01
TL;DR: AB00686963-01 (CAS 893928-47-7) is a chemical compound with molecular formula C18H16N6OS2 and molecular weight 396.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(2,4-dimethylphenyl)pyrazolo[5,4-d]pyrimidin-4-yl]sulfanyl-N-(1,3-thiazol-2-yl)acetamide
Also Known As: AB00686963-01, F1874-0981, 2-{[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide, 2-((1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)thio)-N-(thiazol-2-yl)acetamide, 2-[1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-N-(1,3-thiazol-2-yl)acetamide
| Molecular Formula | C18H16N6OS2 |
|---|---|
| Molecular Weight | 396.08 g/mol |
| LogP | 3.61964 |
| Topological Polar Surface Area | 85.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 396.0827 |
| Heavy Atoms | 27 |
| Complexity | 1106.4529 |
Chemical Identifiers
| CAS Number | 893928-47-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC(=O)NC4=NC=CS4)C |
Product Overview
AB00686963-01 (CAS 893928-47-7), with molecular formula C18H16N6OS2 and molecular weight 396.08 g/mol. IUPAC: 2-[1-(2,4-dimethylphenyl)pyrazolo[5,4-d]pyrimidin-4-yl]sulfanyl-N-(1,3-thiazol-2-yl)acetamide.
Chemical Property Profile of AB00686963-01
Property Insights of AB00686963-01
The XLogP value of 3.61964 indicates that AB00686963-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.59 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00686963-01. Following Lipinski's Rule of Five, AB00686963-01 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 AB00686963-01?
The CAS number of AB00686963-01 is 893928-47-7.
What is the molecular formula of AB00686963-01?
The molecular formula of AB00686963-01 is C18H16N6OS2.
What is the molecular weight of AB00686963-01?
The molecular weight of AB00686963-01 is 396.08 g/mol.
Where can I buy AB00686963-01?
You can request a quote for AB00686963-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00686963-01?
Yes, KEHONG BIO provides custom synthesis services for AB00686963-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.