AH-034/34958033
TL;DR: AH-034/34958033 (CAS 313530-28-8) is a chemical compound with molecular formula C21H16FNO4S2 and molecular weight 429.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-methoxy-4-[(E)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-fluorobenzoate
Also Known As: AH-034/34958033, [2-methoxy-4-[(E)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-fluorobenzoate, 4-[(3-allyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 4-fluorobenzoate, (E)-4-((3-allyl-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-2-methoxyphenyl 4-fluorobenzoate, 2-methoxy-4-[(4-oxo-3-prop-2-enyl-2-thioxo(1,3-thiazolidin-5-ylidene))methyl]p henyl 4-fluorobenzoate
| Molecular Formula | C21H16FNO4S2 |
|---|---|
| Molecular Weight | 429.05 g/mol |
| LogP | 4.4407 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 429.05048 |
| Heavy Atoms | 29 |
| Complexity | 1017.8412 |
Chemical Identifiers
| CAS Number | 313530-28-8 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=C/2\C(=O)N(C(=S)S2)CC=C)OC(=O)C3=CC=C(C=C3)F |
Product Overview
AH-034/34958033 (CAS 313530-28-8), with molecular formula C21H16FNO4S2 and molecular weight 429.05 g/mol. IUPAC: [2-methoxy-4-[(E)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-fluorobenzoate.
Chemical Property Profile of AH-034/34958033
Property Insights of AH-034/34958033
The XLogP value of 4.4407 indicates that AH-034/34958033 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.84 Ų, AH-034/34958033 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AH-034/34958033 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 AH-034/34958033?
The CAS number of AH-034/34958033 is 313530-28-8.
What is the molecular formula of AH-034/34958033?
The molecular formula of AH-034/34958033 is C21H16FNO4S2.
What is the molecular weight of AH-034/34958033?
The molecular weight of AH-034/34958033 is 429.05 g/mol.
Where can I buy AH-034/34958033?
You can request a quote for AH-034/34958033 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AH-034/34958033?
Yes, KEHONG BIO provides custom synthesis services for AH-034/34958033 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.