AB01315652-02
TL;DR: AB01315652-02 (CAS 899393-12-5) is a chemical compound with molecular formula C18H16O6S and molecular weight 360.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2Z)-2-[(4-methoxyphenyl)methylidene]-7-methyl-3-oxo-1-benzofuran-6-yl] methanesulfonate
Also Known As: AB01315652-02, F3385-2433, (2Z)-2-(4-methoxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-yl methanesulfonate, (2Z)-2-[(4-methoxyphenyl)methylidene]-7-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-yl methanesulfonate, (Z)-2-(4-methoxybenzylidene)-7-methyl-3-oxo-2,3-dihydrobenzofuran-6-yl methanesulfonate
| Molecular Formula | C18H16O6S |
|---|---|
| Molecular Weight | 360.07 g/mol |
| LogP | 2.95822 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 360.06677 |
| Heavy Atoms | 25 |
| Complexity | 971.37103 |
Chemical Identifiers
| CAS Number | 899393-12-5 |
|---|---|
| SMILES | CC1=C(C=CC2=C1O/C(=C\C3=CC=C(C=C3)OC)/C2=O)OS(=O)(=O)C |
Product Overview
AB01315652-02 (CAS 899393-12-5), with molecular formula C18H16O6S and molecular weight 360.07 g/mol. IUPAC: [(2Z)-2-[(4-methoxyphenyl)methylidene]-7-methyl-3-oxo-1-benzofuran-6-yl] methanesulfonate.
Chemical Property Profile of AB01315652-02
Property Insights of AB01315652-02
The XLogP value of 2.95822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01315652-02. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01315652-02. Following Lipinski's Rule of Five, AB01315652-02 has 0 hydrogen bond donor(s) and 6 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 AB01315652-02?
The CAS number of AB01315652-02 is 899393-12-5.
What is the molecular formula of AB01315652-02?
The molecular formula of AB01315652-02 is C18H16O6S.
What is the molecular weight of AB01315652-02?
The molecular weight of AB01315652-02 is 360.07 g/mol.
Where can I buy AB01315652-02?
You can request a quote for AB01315652-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01315652-02?
Yes, KEHONG BIO provides custom synthesis services for AB01315652-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.