N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine
TL;DR: N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine (CAS 475587-23-6) is a chemical compound with molecular formula C16H13N5O2 and molecular weight 307.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methyl-5-nitrophenyl)-4-pyridin-2-ylpyrimidin-2-amine
Also Known As: Imatinib Impurity 36, N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine, N-(2-methyl-5-nitrophenyl)-4-pyridin-2-ylpyrimidin-2-amine, PYRIMIDIN-2-AMINE, N-(2-METHYL-5-NITROPHENYL)-4-(2-PYRIDINYL)-, N-(2-methyl-5-nitro-phenyl)-4-pyridin-2-yl-pyrimidin-2-amine
| Molecular Formula | C16H13N5O2 |
|---|---|
| Molecular Weight | 307.11 g/mol |
| LogP | 3.49882 |
| Topological Polar Surface Area | 93.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.10693 |
| Heavy Atoms | 23 |
| Complexity | 852.09924 |
Chemical Identifiers
| CAS Number | 475587-23-6 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])NC2=NC=CC(=N2)C3=CC=CC=N3 |
Product Overview
N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine (CAS 475587-23-6), with molecular formula C16H13N5O2 and molecular weight 307.11 g/mol. IUPAC: N-(2-methyl-5-nitrophenyl)-4-pyridin-2-ylpyrimidin-2-amine.
Chemical Property Profile of N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine
Property Insights of N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine
The XLogP value of 3.49882 indicates that N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.84 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine. Following Lipinski's Rule of Five, N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine 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 N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine?
The CAS number of N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine is 475587-23-6.
What is the molecular formula of N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine?
The molecular formula of N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine is C16H13N5O2.
What is the molecular weight of N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine?
The molecular weight of N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine is 307.11 g/mol.
Where can I buy N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine?
You can request a quote for N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Methyl-5-nitrophenyl)-4-(2-pyridinyl)-2-pyrimidinamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.