AB00115437-01
TL;DR: AB00115437-01 (CAS 381198-40-9) is a chemical compound with molecular formula C22H18ClN3O4S2 and molecular weight 487.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chlorophenyl)-2-[(3Z)-3-[3-(2-methoxyethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]acetamide
Also Known As: AB00115437-01, N-(3-chlorophenyl)-2-[(3Z)-3-[3-(2-methoxyethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]acetamide, N-(3-chlorophenyl)-2-{(3Z)-3-[3-(2-methoxyethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}acetamide, (Z)-N-(3-chlorophenyl)-2-(3-(3-(2-methoxyethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)-2-oxoindolin-1-yl)acetamide
| Molecular Formula | C22H18ClN3O4S2 |
|---|---|
| Molecular Weight | 487.04 g/mol |
| LogP | 3.5431 |
| Topological Polar Surface Area | 78.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 487.04272 |
| Heavy Atoms | 32 |
| Complexity | 1167.3699 |
Chemical Identifiers
| CAS Number | 381198-40-9 |
|---|---|
| SMILES | COCCN1C(=O)/C(=C/2\C3=CC=CC=C3N(C2=O)CC(=O)NC4=CC(=CC=C4)Cl)/SC1=S |
Product Overview
AB00115437-01 (CAS 381198-40-9), with molecular formula C22H18ClN3O4S2 and molecular weight 487.04 g/mol. IUPAC: N-(3-chlorophenyl)-2-[(3Z)-3-[3-(2-methoxyethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]acetamide.
Chemical Property Profile of AB00115437-01
Property Insights of AB00115437-01
The XLogP value of 3.5431 indicates that AB00115437-01 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 AB00115437-01. Following Lipinski's Rule of Five, AB00115437-01 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 AB00115437-01?
The CAS number of AB00115437-01 is 381198-40-9.
What is the molecular formula of AB00115437-01?
The molecular formula of AB00115437-01 is C22H18ClN3O4S2.
What is the molecular weight of AB00115437-01?
The molecular weight of AB00115437-01 is 487.04 g/mol.
Where can I buy AB00115437-01?
You can request a quote for AB00115437-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00115437-01?
Yes, KEHONG BIO provides custom synthesis services for AB00115437-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.