PI5P4Ks-IN-1
TL;DR: PI5P4Ks-IN-1 (CAS 959560-36-2) is a chemical compound with molecular formula C20H17N3S and molecular weight 331.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methylphenyl)-N-(thiophen-2-ylmethyl)quinazolin-4-amine
Also Known As: PI5P4Ks-IN-1, N-(Thiophen-2-ylmethyl)-2-(o-tolyl)quinazolin-4-amine, 2-(2-methylphenyl)-N-(thiophen-2-ylmethyl)quinazolin-4-amine
| Molecular Formula | C20H17N3S |
|---|---|
| Molecular Weight | 331.11 g/mol |
| LogP | 5.27882 |
| Topological Polar Surface Area | 37.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 331.11432 |
| Heavy Atoms | 24 |
| Complexity | 977.27966 |
Chemical Identifiers
| CAS Number | 959560-36-2 |
|---|---|
| SMILES | CC1=CC=CC=C1C2=NC3=CC=CC=C3C(=N2)NCC4=CC=CS4 |
Product Overview
PI5P4Ks-IN-1 (CAS 959560-36-2), with molecular formula C20H17N3S and molecular weight 331.11 g/mol. IUPAC: 2-(2-methylphenyl)-N-(thiophen-2-ylmethyl)quinazolin-4-amine.
Chemical Property Profile of PI5P4Ks-IN-1
Property Insights of PI5P4Ks-IN-1
The XLogP value of 5.27882 indicates that PI5P4Ks-IN-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.81 Ų, PI5P4Ks-IN-1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, PI5P4Ks-IN-1 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of PI5P4Ks-IN-1?
The CAS number of PI5P4Ks-IN-1 is 959560-36-2.
What is the molecular formula of PI5P4Ks-IN-1?
The molecular formula of PI5P4Ks-IN-1 is C20H17N3S.
What is the molecular weight of PI5P4Ks-IN-1?
The molecular weight of PI5P4Ks-IN-1 is 331.11 g/mol.
Where can I buy PI5P4Ks-IN-1?
You can request a quote for PI5P4Ks-IN-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for PI5P4Ks-IN-1?
Yes, KEHONG BIO provides custom synthesis services for PI5P4Ks-IN-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.