VU0144054-4
TL;DR: VU0144054-4 (CAS 851716-65-9) is a chemical compound with molecular formula C14H11FN2O2S2 and molecular weight 322.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-[2-[(6-fluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)amino]-2-oxoethyl] ethanethioate
Also Known As: VU0144054-4, S-[2-[(6-fluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)amino]-2-oxoethyl] ethanethioate, 2-(acetylsulfanyl)-N-[(2Z)-6-fluoro-3-(prop-2-yn-1-yl)-2,3-dihydro-1,3-benzothiazol-2-ylidene]acetamide, (Z)-S-(2-((6-fluoro-3-(prop-2-yn-1-yl)benzo[d]thiazol-2(3H)-ylidene)amino)-2-oxoethyl) ethanethioate, ethanethioic acid S-[2-[(6-fluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)amino]-2-oxoethyl] ester
| Molecular Formula | C14H11FN2O2S2 |
|---|---|
| Molecular Weight | 322.02 g/mol |
| LogP | 2.1821 |
| Topological Polar Surface Area | 51.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 322.0246 |
| Heavy Atoms | 21 |
| Complexity | 814.4688 |
Chemical Identifiers
| CAS Number | 851716-65-9 |
|---|---|
| SMILES | CC(=O)SCC(=O)N=C1N(C2=C(S1)C=C(C=C2)F)CC#C |
Product Overview
VU0144054-4 (CAS 851716-65-9), with molecular formula C14H11FN2O2S2 and molecular weight 322.02 g/mol. IUPAC: S-[2-[(6-fluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)amino]-2-oxoethyl] ethanethioate.
Chemical Property Profile of VU0144054-4
Property Insights of VU0144054-4
The XLogP value of 2.1821 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0144054-4. With a topological polar surface area (TPSA) of 51.43 Ų, VU0144054-4 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, VU0144054-4 has 0 hydrogen bond donor(s) and 4 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 VU0144054-4?
The CAS number of VU0144054-4 is 851716-65-9.
What is the molecular formula of VU0144054-4?
The molecular formula of VU0144054-4 is C14H11FN2O2S2.
What is the molecular weight of VU0144054-4?
The molecular weight of VU0144054-4 is 322.02 g/mol.
Where can I buy VU0144054-4?
You can request a quote for VU0144054-4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0144054-4?
Yes, KEHONG BIO provides custom synthesis services for VU0144054-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.