6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine
TL;DR: 6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine (CAS 713094-80-5) is a chemical compound with molecular formula C13H20N6O2 and molecular weight 292.16 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-prop-2-enylpyrimidine-2,4-diamine
Also Known As: N2-allyl-6-(3-methylpiperidin-1-yl)-5-nitropyrimidine-2,4-diamine, 6-(3-methylpiperidin-1-yl)-5-nitro-2-N-prop-2-enylpyrimidine-2,4-diamine, 6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine
| Molecular Formula | C13H20N6O2 |
|---|---|
| Molecular Weight | 292.16 g/mol |
| LogP | 1.8012 |
| Topological Polar Surface Area | 110.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 292.16476 |
| Heavy Atoms | 21 |
| Complexity | 547.7082 |
Chemical Identifiers
| CAS Number | 713094-80-5 |
|---|---|
| SMILES | CC1CCCN(C1)C2=NC(=NC(=C2[N+](=O)[O-])N)NCC=C |
Product Overview
6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine (CAS 713094-80-5), with molecular formula C13H20N6O2 and molecular weight 292.16 g/mol. IUPAC: 6-(3-methylpiperidin-1-yl)-5-nitro-2-N-prop-2-enylpyrimidine-2,4-diamine.
Chemical Property Profile of 6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine
Property Insights of 6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine
The XLogP value of 1.8012 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine. The TPSA of 110.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine. Following Lipinski's Rule of Five, 6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine 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-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine?
The CAS number of 6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine is 713094-80-5.
What is the molecular formula of 6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine?
The molecular formula of 6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine is C13H20N6O2.
What is the molecular weight of 6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine?
The molecular weight of 6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine is 292.16 g/mol.
Where can I buy 6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine?
You can request a quote for 6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.