![2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol structure](/static/products/4503/450344-83-9.webp)
2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol
TL;DR: 2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol (CAS 450344-83-9) is a chemical compound with molecular formula C8H13N5O3 and molecular weight 227.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(6-amino-5-nitropyrimidin-4-yl)amino]butan-1-ol
Also Known As: 2-((6-amino-5-nitropyrimidin-4-yl)amino)butan-1-ol, 2-(6-Amino-5-nitro-pyrimidin-4-ylamino)-butan-1-ol, 2-[(6-amino-5-nitropyrimidin-4-yl)amino]butan-1-ol, AB00668213-01, F0543-0025
| Molecular Formula | C8H13N5O3 |
|---|---|
| Molecular Weight | 227.10 g/mol |
| LogP | 0.1498 |
| Topological Polar Surface Area | 127.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 227.10184 |
| Heavy Atoms | 16 |
| Complexity | 379.93658 |
Chemical Identifiers
| CAS Number | 450344-83-9 |
|---|---|
| SMILES | CCC(CO)NC1=NC=NC(=C1[N+](=O)[O-])N |
Product Overview
2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol (CAS 450344-83-9), with molecular formula C8H13N5O3 and molecular weight 227.10 g/mol. IUPAC: 2-[(6-amino-5-nitropyrimidin-4-yl)amino]butan-1-ol.
Chemical Property Profile of 2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol
Property Insights of 2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol
The XLogP value of 0.1498 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol. The TPSA of 127.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol. Following Lipinski's Rule of Five, 2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol has 3 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 2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol?
The CAS number of 2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol is 450344-83-9.
What is the molecular formula of 2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol?
The molecular formula of 2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol is C8H13N5O3.
What is the molecular weight of 2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol?
The molecular weight of 2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol is 227.10 g/mol.
Where can I buy 2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol?
You can request a quote for 2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-[(6-Amino-5-nitropyrimidin-4-yl)amino]butan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.