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AT-057/41290482 structure
Fine Chemical

AT-057/41290482

TL;DR: AT-057/41290482 (CAS 1008704-14-0) is a chemical compound with molecular formula C19H18N2O4S and molecular weight 370.09872 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

methyl 3-[[5-(2-methylanilino)-2,4-dioxo-1,3-thiazolidin-3-yl]methyl]benzoate

Also Known As: AT-057/41290482, methyl 3-({5-[(2-methylphenyl)amino]-2,4-dioxo-1,3-thiazolidin-3-yl}methyl)benzoate, methyl 3-[[5-(2-methylanilino)-2,4-dioxo-1,3-thiazolidin-3-yl]methyl]benzoate, methyl 3-((2,4-dioxo-5-(o-tolylamino)thiazolidin-3-yl)methyl)benzoate, methyl 3-({5-[(2-methylphenyl)amino]-2,4-dioxo-1,3-thiazolidin-3-yl}methyl)ben zoate

CAS Number
1008704-14-0
Molecular Formula
C19H18N2O4S
Molecular Weight
370.09872 g/mol
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Technical Specifications

Molecular FormulaC19H18N2O4S
Molecular Weight370.09872 g/mol
XLogP3.8
Topological Polar Surface Area (TPSA)101.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds6
Exact Mass370.09872 Da
Heavy Atoms26
Complexity556.0
SMILESCC1=CC=CC=C1NC2C(=O)N(C(=O)S2)CC3=CC(=CC=C3)C(=O)OC
InChIKeyVGRCYJRHIFKFSB-UHFFFAOYSA-N

Chemical Property Profile of AT-057/41290482

XLogP
3.8
TPSA (Topological Polar Surface Area)
101.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
6
Heavy Atoms
26
Complexity
556.0
Exact Mass
370.09872
Monoisotopic Mass
370.09872
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of AT-057/41290482

The XLogP value of 3.8 indicates that AT-057/41290482 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AT-057/41290482. Following Lipinski's Rule of Five, AT-057/41290482 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

What is the CAS number of AT-057/41290482?

The CAS number of AT-057/41290482 is 1008704-14-0.

What is the molecular formula of AT-057/41290482?

The molecular formula of AT-057/41290482 is C19H18N2O4S.

What is the molecular weight of AT-057/41290482?

The molecular weight of AT-057/41290482 is 370.09872 g/mol.

Where can I buy AT-057/41290482?

You can request a quote for AT-057/41290482 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for AT-057/41290482?

Yes, CoreyChem provides custom synthesis services for AT-057/41290482 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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