4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr
TL;DR: 4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr (CAS 129224-85-7) is a chemical compound with molecular formula C17H20N4S2 and molecular weight 344.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-2-[4-(1-methylpyrrol-2-yl)-6-thiophen-2-ylpyrimidin-2-yl]sulfanylethanamine
Also Known As: 4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr, Ethanamine, N,N-dimethyl-2-((4-(1-methyl-1H-pyrrol-2-yl)-6-(2-thienyl)-2-pyrimidinyl)thio)-, Ethanamine,N,N-dimethyl-2-[[4-(1-methyl-1H-pyrrol-2-yl)-6-(2-thienyl)-2-pyrimidinyl]thio]-,hydrobromide (1:1), 2-(2-Dimethylaminoethylthio)-4-(1-methyl-1H-pyrrol-2-yl)-6-(2-thienyl)pyrimidine, N,N-dimethyl-2-[4-(1-methylpyrrol-2-yl)-6-(2-thienyl)pyrimidin-2-yl]sulfanyl-ethanamine
| Molecular Formula | C17H20N4S2 |
|---|---|
| Molecular Weight | 344.11 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 87.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 344.11295 |
| Heavy Atoms | 23 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 129224-85-7 |
|---|---|
| SMILES | CN1C=CC=C1C2=CC(=NC(=N2)SCCN(C)C)C3=CC=CS3 |
| InChIKey | DHITVGBSDWRITB-UHFFFAOYSA-N |
Product Overview
4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr (CAS 129224-85-7), with molecular formula C17H20N4S2 and molecular weight 344.11 g/mol. IUPAC: N,N-dimethyl-2-[4-(1-methylpyrrol-2-yl)-6-thiophen-2-ylpyrimidin-2-yl]sulfanylethanamine.
Chemical Property Profile of 4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr
Property Insights of 4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr. The TPSA of 87.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr. Following Lipinski's Rule of Five, 4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr has 0 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 4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr?
The CAS number of 4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr is 129224-85-7.
What is the molecular formula of 4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr?
The molecular formula of 4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr is C17H20N4S2.
What is the molecular weight of 4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr?
The molecular weight of 4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr is 344.11 g/mol.
Where can I buy 4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr?
You can request a quote for 4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr?
Yes, KEHONG BIO provides custom synthesis services for 4Thienyl-6(1-MePyrrol)-2SEtNMe2-Pyr and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.