2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)-
TL;DR: 2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)- (CAS 112676-07-0) is a chemical compound with molecular formula C15H11ClN4 and molecular weight 282.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chlorophenyl)-4-pyridin-4-ylpyrimidin-2-amine
Also Known As: 2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)-, N-(3-chlorophenyl)-4-pyridin-4-ylpyrimidin-2-amine, N-(3-chloro-phenyl)-4-(4-pyridyl)-2-pyrimidineamine, N-(3-chloro-phenyl)-4-pyridyl-2-pyrimidineamine, 2-Pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)- (9CI)
| Molecular Formula | C15H11ClN4 |
|---|---|
| Molecular Weight | 282.07 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 50.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.06723 |
| Heavy Atoms | 20 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 112676-07-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)NC2=NC=CC(=N2)C3=CC=NC=C3 |
| InChIKey | SWVIGWACYFGDBA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)- (CAS 112676-07-0), with molecular formula C15H11ClN4 and molecular weight 282.07 g/mol. IUPAC: N-(3-chlorophenyl)-4-pyridin-4-ylpyrimidin-2-amine.
Chemical Property Profile of 2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)-
Property Insights of 2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)-
The XLogP value of 3.3 indicates that 2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.7 Ų, 2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)- has 1 hydrogen bond donor(s) and 4 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 2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)-?
The CAS number of 2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)- is 112676-07-0.
What is the molecular formula of 2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)-?
The molecular formula of 2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)- is C15H11ClN4.
What is the molecular weight of 2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)-?
The molecular weight of 2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)- is 282.07 g/mol.
Where can I buy 2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)-?
You can request a quote for 2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-pyrimidinamine, N-(3-chlorophenyl)-4-(4-pyridinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.