N-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine
TL;DR: N-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine (CAS 673453-04-8) is a chemical compound with molecular formula C13H22N6O3 and molecular weight 310.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N-(2-methylpropyl)-5-nitro-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4,6-triamine
Also Known As: 2-N-(2-methylpropyl)-5-nitro-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4,6-triamine, N-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine, N2-isobutyl-5-nitro-N4-((tetrahydrofuran-2-yl)methyl)pyrimidine-2,4,6-triamine, [6-amino-2-(isobutylamino)-5-nitro-pyrimidin-4-yl]-(tetrahydrofurfuryl)amine, {6-amino-2-[(2-methylpropyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethyl)am ine
| Molecular Formula | C13H22N6O3 |
|---|---|
| Molecular Weight | 310.18 g/mol |
| LogP | 1.6258 |
| Topological Polar Surface Area | 128.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 310.17532 |
| Heavy Atoms | 22 |
| Complexity | 530.7519 |
Chemical Identifiers
| CAS Number | 673453-04-8 |
|---|---|
| SMILES | CC(C)CNC1=NC(=C(C(=N1)NCC2CCCO2)[N+](=O)[O-])N |
Product Overview
N-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine (CAS 673453-04-8), with molecular formula C13H22N6O3 and molecular weight 310.18 g/mol. IUPAC: 2-N-(2-methylpropyl)-5-nitro-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4,6-triamine.
Chemical Property Profile of N-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine
Property Insights of N-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine
The XLogP value of 1.6258 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine. The TPSA of 128.23 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine. Following Lipinski's Rule of Five, N-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine has 3 hydrogen bond donor(s) and 8 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-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine?
The CAS number of N-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine is 673453-04-8.
What is the molecular formula of N-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine?
The molecular formula of N-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine is C13H22N6O3.
What is the molecular weight of N-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine?
The molecular weight of N-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine is 310.18 g/mol.
Where can I buy N-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine?
You can request a quote for N-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine?
Yes, KEHONG BIO provides custom synthesis services for N-Isobutyl-5-nitro-N'-(tetrahydro-furan-2-ylmethyl)-pyrimidine-2,4,6-triamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.