RefChem:1091903
TL;DR: RefChem:1091903 (CAS 55921-72-7) is a chemical compound with molecular formula C14H25N5OS and molecular weight 311.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-4-(4-methylpiperazin-1-yl)-5-methylsulfanyl-6-propoxypyrimidin-2-amine
Also Known As: n-methyl-4-(4-methylpiperazin-1-yl)-5-(methylsulfanyl)-6-propoxypyrimidin-2-amine, 5-25-13-00310 (Beilstein Handbook Reference), n-methyl-4-5-methylthio-6-propyl-2-pyrimidinamine, 2-Methylamino-4-(N-methylpiperazino)-5-methylthio-6-(n-propoxy)pyrimidine, Pyrimidine, 2-methylamino-4-(4-methylpiperazino)-5-methylthio-6-(n-propoxy)-
| Molecular Formula | C14H25N5OS |
|---|---|
| Molecular Weight | 311.18 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 78.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 311.17798 |
| Heavy Atoms | 21 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 55921-72-7 |
|---|---|
| SMILES | CCCOC1=NC(=NC(=C1SC)N2CCN(CC2)C)NC |
| InChIKey | QQKRZANWFLYUMS-UHFFFAOYSA-N |
Product Overview
RefChem:1091903 (CAS 55921-72-7), with molecular formula C14H25N5OS and molecular weight 311.18 g/mol. IUPAC: N-methyl-4-(4-methylpiperazin-1-yl)-5-methylsulfanyl-6-propoxypyrimidin-2-amine.
Chemical Property Profile of RefChem:1091903
Property Insights of RefChem:1091903
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1091903. The TPSA of 78.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1091903. Following Lipinski's Rule of Five, RefChem:1091903 has 1 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 RefChem:1091903?
The CAS number of RefChem:1091903 is 55921-72-7.
What is the molecular formula of RefChem:1091903?
The molecular formula of RefChem:1091903 is C14H25N5OS.
What is the molecular weight of RefChem:1091903?
The molecular weight of RefChem:1091903 is 311.18 g/mol.
Where can I buy RefChem:1091903?
You can request a quote for RefChem:1091903 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1091903?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1091903 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.