6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine
TL;DR: 6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine (CAS 866151-09-9) is a chemical compound with molecular formula C13H13ClN4O2 and molecular weight 292.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-5-nitro-N-phenyl-N-propan-2-ylpyrimidin-4-amine
Also Known As: 6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine, 6-chloro-5-nitro-N-phenyl-N-(propan-2-yl)pyrimidin-4-amine, 6-chloro-5-nitro-N-phenyl-N-propan-2-ylpyrimidin-4-amine, 6-chloro-N-isopropyl-5-nitro-N-phenyl-pyrimidin-4-amine
| Molecular Formula | C13H13ClN4O2 |
|---|---|
| Molecular Weight | 292.07 g/mol |
| LogP | 3.5847 |
| Topological Polar Surface Area | 72.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 292.0727 |
| Heavy Atoms | 20 |
| Complexity | 619.02313 |
Chemical Identifiers
| CAS Number | 866151-09-9 |
|---|---|
| SMILES | CC(C)N(C1=CC=CC=C1)C2=C(C(=NC=N2)Cl)[N+](=O)[O-] |
Product Overview
6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine (CAS 866151-09-9), with molecular formula C13H13ClN4O2 and molecular weight 292.07 g/mol. IUPAC: 6-chloro-5-nitro-N-phenyl-N-propan-2-ylpyrimidin-4-amine.
Chemical Property Profile of 6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine
Property Insights of 6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine
The XLogP value of 3.5847 indicates that 6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine. Following Lipinski's Rule of Five, 6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine has 0 hydrogen bond donor(s) and 5 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 6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine?
The CAS number of 6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine is 866151-09-9.
What is the molecular formula of 6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine?
The molecular formula of 6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine is C13H13ClN4O2.
What is the molecular weight of 6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine?
The molecular weight of 6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine is 292.07 g/mol.
Where can I buy 6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine?
You can request a quote for 6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine?
Yes, KEHONG BIO provides custom synthesis services for 6-chloro-N-isopropyl-5-nitro-N-phenyl-4-pyrimidinamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.