AB00115330-01
TL;DR: AB00115330-01 (CAS 431884-91-2) is a chemical compound with molecular formula C24H21N3O4S and molecular weight 447.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5Z)-5-[[1-(4-methoxyphenyl)pyrrol-2-yl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(4-methylphenyl)acetamide
Also Known As: AB00115330-01, AN-698/40781778, 2-[(5Z)-5-[[1-(4-methoxyphenyl)pyrrol-2-yl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(4-methylphenyl)acetamide, 2-[(5Z)-5-{[1-(4-methoxyphenyl)-1H-pyrrol-2-yl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(4-methylphenyl)acetamide, 2-(5-{[1-(4-methoxyphenyl)-1H-pyrrol-2-yl]methylene}-2,4-dioxo-1,3-thiazolidin-3-yl)-N-(4-methylphenyl)acetamide
| Molecular Formula | C24H21N3O4S |
|---|---|
| Molecular Weight | 447.13 g/mol |
| LogP | 4.46932 |
| Topological Polar Surface Area | 80.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 447.12527 |
| Heavy Atoms | 32 |
| Complexity | 1196.7421 |
Chemical Identifiers
| CAS Number | 431884-91-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)CN2C(=O)/C(=C/C3=CC=CN3C4=CC=C(C=C4)OC)/SC2=O |
Product Overview
AB00115330-01 (CAS 431884-91-2), with molecular formula C24H21N3O4S and molecular weight 447.13 g/mol. IUPAC: 2-[(5Z)-5-[[1-(4-methoxyphenyl)pyrrol-2-yl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(4-methylphenyl)acetamide.
Chemical Property Profile of AB00115330-01
Property Insights of AB00115330-01
The XLogP value of 4.46932 indicates that AB00115330-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.64 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00115330-01. Following Lipinski's Rule of Five, AB00115330-01 has 1 hydrogen bond donor(s) and 5 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 AB00115330-01?
The CAS number of AB00115330-01 is 431884-91-2.
What is the molecular formula of AB00115330-01?
The molecular formula of AB00115330-01 is C24H21N3O4S.
What is the molecular weight of AB00115330-01?
The molecular weight of AB00115330-01 is 447.13 g/mol.
Where can I buy AB00115330-01?
You can request a quote for AB00115330-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00115330-01?
Yes, KEHONG BIO provides custom synthesis services for AB00115330-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.