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UK 1a structure
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UK 1a

TL;DR: UK 1a (CAS 124190-28-9) is a chemical compound with molecular formula C17H27N3O6S and molecular weight 401.16205 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-(1-carboxy-2-hydroxypropyl)-4-{[5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl}-3-methyl-3,4-dihydro-2h-pyrrole-5-carboxylic acid

2-(1-carboxy-2-hydroxypropyl)-4-[5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl-3-methyl-3,4-dihydro-2H-pyrrole-5-carboxylic acid

Also Known As: UK 1a, Ici 213689, Ici-213,689, ZM 213689, ZM 213,689

CAS Number
124190-28-9
Molecular Formula
C17H27N3O6S
Molecular Weight
401.16205 g/mol
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Technical Specifications

Molecular FormulaC17H27N3O6S
Molecular Weight401.16205 g/mol
XLogP-2.8
Topological Polar Surface Area (TPSA)165.0 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors9
Rotatable Bonds7
Exact Mass401.16205 Da
Heavy Atoms27
Complexity640.0
SMILESCC1C(C(=NC1C(C(C)O)C(=O)O)C(=O)O)SC2CC(NC2)C(=O)N(C)C
InChIKeyCDYPSIIDXKMBLV-UHFFFAOYSA-N

Product Description

Applications: UK 1a is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

A fine chemical supplied by CoreyChem, UK 1a (CAS 124190-28-9) has the molecular formula C17H27N3O6S and a molecular weight of 401.16 g/mol. Synonyms include UK 1a and Ici 213689.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of UK 1a

XLogP
-2.8
TPSA (Topological Polar Surface Area)
165.0
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
9
Rotatable Bonds
7
Heavy Atoms
27
Complexity
640.0
Exact Mass
401.16205
Monoisotopic Mass
401.16205
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 UK 1a

The XLogP value of -2.8 indicates that UK 1a is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 165.0 Ų indicates high polarity, suggesting UK 1a may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, UK 1a has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of UK 1a?

The CAS number of UK 1a is 124190-28-9.

What is the molecular formula of UK 1a?

The molecular formula of UK 1a is C17H27N3O6S.

What is the molecular weight of UK 1a?

The molecular weight of UK 1a is 401.16205 g/mol.

What are the applications of UK 1a?

UK 1a is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

Where can I buy UK 1a?

You can request a quote for UK 1a directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for UK 1a?

Yes, CoreyChem provides custom synthesis services for UK 1a and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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