4-Benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine
TL;DR: 4-Benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine (CAS 2257-72-9) is a chemical compound with molecular formula C21H22ClN3 and molecular weight 351.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine
Also Known As: 4-benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine
| Molecular Formula | C21H22ClN3 |
|---|---|
| Molecular Weight | 351.15 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 351.15024 |
| Heavy Atoms | 25 |
| Complexity | 366.0 |
Chemical Identifiers
| CAS Number | 2257-72-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCCCC2=C(N=C(N=C2Cl)N)CC3=CC=CC=C3 |
| InChIKey | DJMHXTOGLXPISR-UHFFFAOYSA-N |
Product Overview
4-Benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine (CAS 2257-72-9), with molecular formula C21H22ClN3 and molecular weight 351.15 g/mol. IUPAC: 4-benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine.
Chemical Property Profile of 4-Benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine
Property Insights of 4-Benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine
The XLogP value of 6.1 indicates that 4-Benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, 4-Benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine?
The CAS number of 4-Benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine is 2257-72-9.
What is the molecular formula of 4-Benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine?
The molecular formula of 4-Benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine is C21H22ClN3.
What is the molecular weight of 4-Benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine?
The molecular weight of 4-Benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine is 351.15 g/mol.
Where can I buy 4-Benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine?
You can request a quote for 4-Benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 4-Benzyl-6-chloro-5-(4-phenylbutyl)pyrimidin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.