N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide
TL;DR: N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide (CAS 7498-16-0) is a chemical compound with molecular formula C9H13ClN4O and molecular weight 228.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide
Also Known As: N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide, N-(4-Amino-6-chloro-5-pyrimidinyl)-N-butylformamide
| Molecular Formula | C9H13ClN4O |
|---|---|
| Molecular Weight | 228.08 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 72.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 228.07779 |
| Heavy Atoms | 15 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 7498-16-0 |
|---|---|
| SMILES | CCCCN(C=O)C1=C(N=CN=C1Cl)N |
| InChIKey | NCJVYHHJFKBUDJ-UHFFFAOYSA-N |
Product Overview
N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide (CAS 7498-16-0), with molecular formula C9H13ClN4O and molecular weight 228.08 g/mol. IUPAC: N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide.
Chemical Property Profile of N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide
Property Insights of N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide. Following Lipinski's Rule of Five, N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide has 1 hydrogen bond donor(s) and 4 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-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide?
The CAS number of N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide is 7498-16-0.
What is the molecular formula of N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide?
The molecular formula of N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide is C9H13ClN4O.
What is the molecular weight of N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide?
The molecular weight of N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide is 228.08 g/mol.
Where can I buy N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide?
You can request a quote for N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-amino-6-chloropyrimidin-5-yl)-N-butylformamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.