AB00105690-01
TL;DR: AB00105690-01 (CAS 6366-21-8) is a chemical compound with molecular formula C17H14N2O4S and molecular weight 342.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-2,5-dimethylpyrrol-1-yl]benzoic acid
Also Known As: AB00105690-01, (Z)-4-(3-((2,4-dioxothiazolidin-5-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid, 4-{3-[(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoic acid, 4-[3-[(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-2,5-dimethyl-pyrrol-1-yl]benzoic Acid, 4-[3-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-2,5-dimethylpyrrol-1-yl]benzoic acid
| Molecular Formula | C17H14N2O4S |
|---|---|
| Molecular Weight | 342.07 g/mol |
| LogP | 3.11624 |
| Topological Polar Surface Area | 88.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 342.0674 |
| Heavy Atoms | 24 |
| Complexity | 894.0595 |
Chemical Identifiers
| CAS Number | 6366-21-8 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)O)C)/C=C\3/C(=O)NC(=O)S3 |
Product Overview
AB00105690-01 (CAS 6366-21-8), with molecular formula C17H14N2O4S and molecular weight 342.07 g/mol. IUPAC: 4-[3-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-2,5-dimethylpyrrol-1-yl]benzoic acid.
Chemical Property Profile of AB00105690-01
Property Insights of AB00105690-01
The XLogP value of 3.11624 indicates that AB00105690-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.4 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00105690-01. Following Lipinski's Rule of Five, AB00105690-01 has 2 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 AB00105690-01?
The CAS number of AB00105690-01 is 6366-21-8.
What is the molecular formula of AB00105690-01?
The molecular formula of AB00105690-01 is C17H14N2O4S.
What is the molecular weight of AB00105690-01?
The molecular weight of AB00105690-01 is 342.07 g/mol.
Where can I buy AB00105690-01?
You can request a quote for AB00105690-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00105690-01?
Yes, KEHONG BIO provides custom synthesis services for AB00105690-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.