AB00113916-01
TL;DR: AB00113916-01 (CAS 381207-40-5) is a chemical compound with molecular formula C24H20FN3O4S2 and molecular weight 497.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-fluorophenyl)-2-[(3Z)-2-oxo-3-[4-oxo-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]indol-1-yl]acetamide
Also Known As: AB00113916-01, N-(4-fluorophenyl)-2-[(3Z)-2-oxo-3-[4-oxo-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]indol-1-yl]acetamide, (Z)-N-(4-fluorophenyl)-2-(2-oxo-3-(4-oxo-3-((tetrahydrofuran-2-yl)methyl)-2-thioxothiazolidin-5-ylidene)indolin-1-yl)acetamide, N-(4-fluorophenyl)-2-{(3Z)-2-oxo-3-[4-oxo-3-(tetrahydro-2-furanylmethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]-2,3-dihydro-1H-indol-1-yl}acetamide, N-(4-fluorophenyl)-2-{(3Z)-2-oxo-3-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]-2,3-dihydro-1H-indol-1-yl}acetamide
| Molecular Formula | C24H20FN3O4S2 |
|---|---|
| Molecular Weight | 497.09 g/mol |
| LogP | 3.5614 |
| Topological Polar Surface Area | 78.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 497.08792 |
| Heavy Atoms | 34 |
| Complexity | 1224.9788 |
Chemical Identifiers
| CAS Number | 381207-40-5 |
|---|---|
| SMILES | C1CC(OC1)CN2C(=O)/C(=C/3\C4=CC=CC=C4N(C3=O)CC(=O)NC5=CC=C(C=C5)F)/SC2=S |
Product Overview
AB00113916-01 (CAS 381207-40-5), with molecular formula C24H20FN3O4S2 and molecular weight 497.09 g/mol. IUPAC: N-(4-fluorophenyl)-2-[(3Z)-2-oxo-3-[4-oxo-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]indol-1-yl]acetamide.
Chemical Property Profile of AB00113916-01
Property Insights of AB00113916-01
The XLogP value of 3.5614 indicates that AB00113916-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.95 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00113916-01. Following Lipinski's Rule of Five, AB00113916-01 has 1 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 AB00113916-01?
The CAS number of AB00113916-01 is 381207-40-5.
What is the molecular formula of AB00113916-01?
The molecular formula of AB00113916-01 is C24H20FN3O4S2.
What is the molecular weight of AB00113916-01?
The molecular weight of AB00113916-01 is 497.09 g/mol.
Where can I buy AB00113916-01?
You can request a quote for AB00113916-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00113916-01?
Yes, KEHONG BIO provides custom synthesis services for AB00113916-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.