6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine
TL;DR: 6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine (CAS 7151-18-0) is a chemical compound with molecular formula C12H14N4S and molecular weight 246.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine
Also Known As: 6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine, 6-(benzylsulfanyl)-n4-methylpyrimidine-2,4-diamine, 2,4-Pyrimidinediamine, N4-methyl-6-[(phenylmethyl)thio]-, 6-(Benzylsulfanyl)-2-imino-N-methyl-2,3-dihydropyrimidin-4-amine
| Molecular Formula | C12H14N4S |
|---|---|
| Molecular Weight | 246.09 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 89.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 246.09392 |
| Heavy Atoms | 17 |
| Complexity | 221.0 |
Chemical Identifiers
| CAS Number | 7151-18-0 |
|---|---|
| SMILES | CNC1=CC(=NC(=N1)N)SCC2=CC=CC=C2 |
| InChIKey | HOOPCRXZRUPHJW-UHFFFAOYSA-N |
Product Overview
6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine (CAS 7151-18-0), with molecular formula C12H14N4S and molecular weight 246.09 g/mol. IUPAC: 6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine.
Chemical Property Profile of 6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine
Property Insights of 6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine. The TPSA of 89.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine. Following Lipinski's Rule of Five, 6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine has 2 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 6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine?
The CAS number of 6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine is 7151-18-0.
What is the molecular formula of 6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine?
The molecular formula of 6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine is C12H14N4S.
What is the molecular weight of 6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine?
The molecular weight of 6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine is 246.09 g/mol.
Where can I buy 6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine?
You can request a quote for 6-benzylsulfanyl-4-N-methylpyrimidine-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-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 6-benzylsulfanyl-4-N-methylpyrimidine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.