VU0143985-4
TL;DR: VU0143985-4 (CAS 1164549-66-9) is a chemical compound with molecular formula C15H15FN2O4S2 and molecular weight 370.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-(2-acetylsulfanylacetyl)imino-6-fluoro-1,3-benzothiazol-3-yl]acetate
Also Known As: VU0143985-4, (Z)-ethyl 2-(2-((2-(acetylthio)acetyl)imino)-6-fluorobenzo[d]thiazol-3(2H)-yl)acetate, ethyl 2-[2-(2-acetylsulfanylacetyl)imino-6-fluoro-1,3-benzothiazol-3-yl]acetate, Ethyl (2Z)-2-[[2-(acetylthio)acetyl]imino]-6-fluoro-3(2H)-benzothiazoleacetate, Ethyl [(2Z)-2-{[(acetylsulfanyl)acetyl]imino}-6-fluoro-1,3-benzothiazol-3(2H)-yl]acetate
| Molecular Formula | C15H15FN2O4S2 |
|---|---|
| Molecular Weight | 370.05 g/mol |
| LogP | 2.112 |
| Topological Polar Surface Area | 77.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 370.04572 |
| Heavy Atoms | 24 |
| Complexity | 856.76636 |
Chemical Identifiers
| CAS Number | 1164549-66-9 |
|---|---|
| SMILES | CCOC(=O)CN1C2=C(C=C(C=C2)F)SC1=NC(=O)CSC(=O)C |
Product Overview
VU0143985-4 (CAS 1164549-66-9), with molecular formula C15H15FN2O4S2 and molecular weight 370.05 g/mol. IUPAC: ethyl 2-[2-(2-acetylsulfanylacetyl)imino-6-fluoro-1,3-benzothiazol-3-yl]acetate.
Chemical Property Profile of VU0143985-4
Property Insights of VU0143985-4
The XLogP value of 2.112 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0143985-4. The TPSA of 77.73 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0143985-4. Following Lipinski's Rule of Five, VU0143985-4 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 VU0143985-4?
The CAS number of VU0143985-4 is 1164549-66-9.
What is the molecular formula of VU0143985-4?
The molecular formula of VU0143985-4 is C15H15FN2O4S2.
What is the molecular weight of VU0143985-4?
The molecular weight of VU0143985-4 is 370.05 g/mol.
Where can I buy VU0143985-4?
You can request a quote for VU0143985-4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0143985-4?
Yes, KEHONG BIO provides custom synthesis services for VU0143985-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.