(6-Amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine
TL;DR: (6-Amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine (CAS 836644-89-4) is a chemical compound with molecular formula C15H18N6O2 and molecular weight 314.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-(3-methylphenyl)-5-nitro-2-pyrrolidin-1-ylpyrimidine-4,6-diamine
Also Known As: (6-amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine, 5-nitro-2-(pyrrolidin-1-yl)-N4-(m-tolyl)pyrimidine-4,6-diamine, 4-N-(3-methylphenyl)-5-nitro-2-pyrrolidin-1-ylpyrimidine-4,6-diamine, N-(3-methylphenyl)-5-nitro-2-(pyrrolidin-1-yl)pyrimidine-4,6-diamine, N4-(3-METHYLPHENYL)-5-NITRO-2-(PYRROLIDIN-1-YL)PYRIMIDINE-4,6-DIAMINE
| Molecular Formula | C15H18N6O2 |
|---|---|
| Molecular Weight | 314.15 g/mol |
| LogP | 2.61922 |
| Topological Polar Surface Area | 110.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 314.1491 |
| Heavy Atoms | 23 |
| Complexity | 742.7421 |
Chemical Identifiers
| CAS Number | 836644-89-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)N3CCCC3 |
Product Overview
(6-Amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine (CAS 836644-89-4), with molecular formula C15H18N6O2 and molecular weight 314.15 g/mol. IUPAC: 4-N-(3-methylphenyl)-5-nitro-2-pyrrolidin-1-ylpyrimidine-4,6-diamine.
Chemical Property Profile of (6-Amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine
Property Insights of (6-Amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine
The XLogP value of 2.61922 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (6-Amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine. The TPSA of 110.21 Ų falls within the moderate polarity range, balancing permeability and solubility for (6-Amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine. Following Lipinski's Rule of Five, (6-Amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine 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 (6-Amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine?
The CAS number of (6-Amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine is 836644-89-4.
What is the molecular formula of (6-Amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine?
The molecular formula of (6-Amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine is C15H18N6O2.
What is the molecular weight of (6-Amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine?
The molecular weight of (6-Amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine is 314.15 g/mol.
Where can I buy (6-Amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine?
You can request a quote for (6-Amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6-Amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine?
Yes, KEHONG BIO provides custom synthesis services for (6-Amino-5-nitro-2-pyrrolidinylpyrimidin-4-yl)(3-methylphenyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.