F1366-5040
TL;DR: F1366-5040 (CAS 897734-82-6) is a chemical compound with molecular formula C20H20N2O4S2 and molecular weight 416.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[6-methoxy-2-(3-phenylsulfanylpropanoylimino)-1,3-benzothiazol-3-yl]acetate
Also Known As: F1366-5040, (Z)-methyl 2-(6-methoxy-2-((3-(phenylthio)propanoyl)imino)benzo[d]thiazol-3(2H)-yl)acetate, methyl 2-[(2Z)-6-methoxy-2-{[3-(phenylsulfanyl)propanoyl]imino}-2,3-dihydro-1,3-benzothiazol-3-yl]acetate, methyl 2-[6-methoxy-2-(3-phenylsulfanylpropanoylimino)-1,3-benzothiazol-3-yl]acetate
| Molecular Formula | C20H20N2O4S2 |
|---|---|
| Molecular Weight | 416.09 g/mol |
| LogP | 3.4941 |
| Topological Polar Surface Area | 69.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 416.08646 |
| Heavy Atoms | 28 |
| Complexity | 1041.2904 |
Chemical Identifiers
| CAS Number | 897734-82-6 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)N(C(=NC(=O)CCSC3=CC=CC=C3)S2)CC(=O)OC |
Product Overview
F1366-5040 (CAS 897734-82-6), with molecular formula C20H20N2O4S2 and molecular weight 416.09 g/mol. IUPAC: methyl 2-[6-methoxy-2-(3-phenylsulfanylpropanoylimino)-1,3-benzothiazol-3-yl]acetate.
Chemical Property Profile of F1366-5040
Property Insights of F1366-5040
The XLogP value of 3.4941 indicates that F1366-5040 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.89 Ų falls within the moderate polarity range, balancing permeability and solubility for F1366-5040. Following Lipinski's Rule of Five, F1366-5040 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 F1366-5040?
The CAS number of F1366-5040 is 897734-82-6.
What is the molecular formula of F1366-5040?
The molecular formula of F1366-5040 is C20H20N2O4S2.
What is the molecular weight of F1366-5040?
The molecular weight of F1366-5040 is 416.09 g/mol.
Where can I buy F1366-5040?
You can request a quote for F1366-5040 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1366-5040?
Yes, KEHONG BIO provides custom synthesis services for F1366-5040 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.