[4-Amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine
TL;DR: [4-Amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine (CAS 714252-96-7) is a chemical compound with molecular formula C16H20N6O2 and molecular weight 328.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-methylpiperidin-1-yl)-5-nitro-2-N-phenylpyrimidine-2,4-diamine
Also Known As: [4-amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine|6-(3-methyl-1-piperidyl)-5-nitro-N-phenyl-pyrimidine-2,4-diamine|6-(3-methylpiperidin-1-yl)-5-nitro-2-N-phenylpyrimidine-2,4-diamine|6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-phenylpyrimidine-2,4-diamine|6-(3-methylpiperidin-1-yl)-5-nitro-N2-phenylpyrimidine-2,4-diamine|(2E)-6-(3-methylpiperidin-1-yl)-5-nitro-2-(phenylimino)-2,3-dihydropyrimidin-4-amine
| Molecular Formula | C16H20N6O2 |
|---|---|
| Molecular Weight | 328.16 g/mol |
| LogP | 2.9469 |
| Topological Polar Surface Area | 110.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.16476 |
| Heavy Atoms | 24 |
| Complexity | 736.84753 |
Chemical Identifiers
| CAS Number | 714252-96-7 |
|---|---|
| SMILES | CC1CCCN(C1)C2=NC(=NC(=C2[N+](=O)[O-])N)NC3=CC=CC=C3 |
Product Overview
[4-Amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine (CAS 714252-96-7), with molecular formula C16H20N6O2 and molecular weight 328.16 g/mol. IUPAC: 6-(3-methylpiperidin-1-yl)-5-nitro-2-N-phenylpyrimidine-2,4-diamine.
Chemical Property Profile of [4-Amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine
Property Insights of [4-Amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine
The XLogP value of 2.9469 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-Amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine. The TPSA of 110.21 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-Amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine. Following Lipinski's Rule of Five, [4-Amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine has 2 hydrogen bond donor(s) and 7 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 [4-Amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine?
The CAS number of [4-Amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine is 714252-96-7.
What is the molecular formula of [4-Amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine?
The molecular formula of [4-Amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine is C16H20N6O2.
What is the molecular weight of [4-Amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine?
The molecular weight of [4-Amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine is 328.16 g/mol.
Where can I buy [4-Amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine?
You can request a quote for [4-Amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-Amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine?
Yes, KEHONG BIO provides custom synthesis services for [4-Amino-6-(3-methylpiperidyl)-5-nitropyrimidin-2-yl]phenylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.