N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide
TL;DR: N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide (CAS 7461-79-2) is a chemical compound with molecular formula C19H18N4OS and molecular weight 350.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide
Also Known As: N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide, Formamide, N-[4-amino-6-(benzylthio)-5-pyrimidinyl]-N-benzyl-, N-[4-AMINO-6-(BENZYLSULFANYL)PYRIMIDIN-5-YL]-N-BENZYLFORMAMIDE
| Molecular Formula | C19H18N4OS |
|---|---|
| Molecular Weight | 350.12 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 97.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 350.12012 |
| Heavy Atoms | 25 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 7461-79-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN(C=O)C2=C(N=CN=C2SCC3=CC=CC=C3)N |
| InChIKey | HAQQWLXTUCRJGB-UHFFFAOYSA-N |
Product Overview
N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide (CAS 7461-79-2), with molecular formula C19H18N4OS and molecular weight 350.12 g/mol. IUPAC: N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide.
Chemical Property Profile of N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide
Property Insights of N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide
The XLogP value of 3.1 indicates that N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide. Following Lipinski's Rule of Five, N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide has 1 hydrogen bond donor(s) and 5 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-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide?
The CAS number of N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide is 7461-79-2.
What is the molecular formula of N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide?
The molecular formula of N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide is C19H18N4OS.
What is the molecular weight of N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide?
The molecular weight of N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide is 350.12 g/mol.
Where can I buy N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide?
You can request a quote for N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide 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-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.