AB00625846-02
TL;DR: AB00625846-02 (CAS 872629-91-9) is a chemical compound with molecular formula C16H14ClN5O3S and molecular weight 391.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-amino-1-(4-chlorophenyl)-4-oxopyrimidin-2-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Also Known As: AB00625846-02, F1895-0906, 2-((6-amino-1-(4-chlorophenyl)-4-oxo-1,4-dihydropyrimidin-2-yl)thio)-N-(5-methylisoxazol-3-yl)acetamide, 2-[6-amino-1-(4-chlorophenyl)-4-oxopyrimidin-2-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)acetamide, 2-{[6-amino-1-(4-chlorophenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}-N-(5-methyl-1,2-oxazol-3-yl)acetamide
| Molecular Formula | C16H14ClN5O3S |
|---|---|
| Molecular Weight | 391.05 g/mol |
| LogP | 2.49532 |
| Topological Polar Surface Area | 116.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 391.0506 |
| Heavy Atoms | 26 |
| Complexity | 999.865 |
Chemical Identifiers
| CAS Number | 872629-91-9 |
|---|---|
| SMILES | CC1=CC(=NO1)NC(=O)CSC2=NC(=O)C=C(N2C3=CC=C(C=C3)Cl)N |
Product Overview
AB00625846-02 (CAS 872629-91-9), with molecular formula C16H14ClN5O3S and molecular weight 391.05 g/mol. IUPAC: 2-[6-amino-1-(4-chlorophenyl)-4-oxopyrimidin-2-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)acetamide.
Chemical Property Profile of AB00625846-02
Property Insights of AB00625846-02
The XLogP value of 2.49532 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00625846-02. The TPSA of 116.04 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00625846-02. Following Lipinski's Rule of Five, AB00625846-02 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 AB00625846-02?
The CAS number of AB00625846-02 is 872629-91-9.
What is the molecular formula of AB00625846-02?
The molecular formula of AB00625846-02 is C16H14ClN5O3S.
What is the molecular weight of AB00625846-02?
The molecular weight of AB00625846-02 is 391.05 g/mol.
Where can I buy AB00625846-02?
You can request a quote for AB00625846-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00625846-02?
Yes, KEHONG BIO provides custom synthesis services for AB00625846-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.