UK 177
TL;DR: UK 177 (CAS 59717-63-4) is a chemical compound with molecular formula C17H22ClN5S and molecular weight 363.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
UK 177
N-benzyl-4-chloro-6-(4-methylpiperazin-1-yl)-5-methylsulfanylpyrimidin-2-amine
Also Known As: 2-benzylamino-4-5-6-chloropyrimidine, 2-Benzylamino-4-N-methylpiperazino-5-methylthio-6-chloropyrimidine, 2-Benzylamino-4- -5- -6-chloropyrimidine, N-benzyl-4-chloro-6-(4-methylpiperazin-1-yl)-5-methylsulfanylpyrimidin-2-amine, 2-Pyrimidinamine, 4-chloro-6-(4-methyl-1-piperazinyl)-5-(methylthio)-N-(phenylmethyl)-
| Molecular Formula | C17H22ClN5S |
|---|---|
| Molecular Weight | 363.13 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.12845 |
| Heavy Atoms | 24 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 59717-63-4 |
|---|---|
| SMILES | CN1CCN(CC1)C2=C(C(=NC(=N2)NCC3=CC=CC=C3)Cl)SC |
| InChIKey | YTXNVGNLURBWAL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
UK 177 (CAS 59717-63-4), with molecular formula C17H22ClN5S and molecular weight 363.13 g/mol. IUPAC: N-benzyl-4-chloro-6-(4-methylpiperazin-1-yl)-5-methylsulfanylpyrimidin-2-amine.
Chemical Property Profile of UK 177
Property Insights of UK 177
The XLogP value of 3.8 indicates that UK 177 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for UK 177. Following Lipinski's Rule of Five, UK 177 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 UK 177?
The CAS number of UK 177 is 59717-63-4.
What is the molecular formula of UK 177?
The molecular formula of UK 177 is C17H22ClN5S.
What is the molecular weight of UK 177?
The molecular weight of UK 177 is 363.13 g/mol.
Where can I buy UK 177?
You can request a quote for UK 177 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UK 177?
Yes, KEHONG BIO provides custom synthesis services for UK 177 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.