1,4-Bis(dimethylamino)-2-phenylthio-2-butene
TL;DR: 1,4-Bis(dimethylamino)-2-phenylthio-2-butene (CAS 64037-49-6) is a chemical compound with molecular formula C14H22N2S and molecular weight 250.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N,N',N'-tetramethyl-2-phenylsulfanylbut-2-ene-1,4-diamine
Also Known As: 1,4-Bis -2-phenylthio-2-butene, 1,4-Bis(dimethylamino)-2-phenylthio-2-butene
| Molecular Formula | C14H22N2S |
|---|---|
| Molecular Weight | 250.15 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 31.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 250.15038 |
| Heavy Atoms | 17 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 64037-49-6 |
|---|---|
| SMILES | CN(C)CC=C(CN(C)C)SC1=CC=CC=C1 |
| InChIKey | HSWMXLXOAFVRJE-UHFFFAOYSA-N |
Product Overview
1,4-Bis(dimethylamino)-2-phenylthio-2-butene (CAS 64037-49-6), with molecular formula C14H22N2S and molecular weight 250.15 g/mol. IUPAC: N,N,N',N'-tetramethyl-2-phenylsulfanylbut-2-ene-1,4-diamine.
Chemical Property Profile of 1,4-Bis(dimethylamino)-2-phenylthio-2-butene
Property Insights of 1,4-Bis(dimethylamino)-2-phenylthio-2-butene
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Bis(dimethylamino)-2-phenylthio-2-butene. With a topological polar surface area (TPSA) of 31.8 Ų, 1,4-Bis(dimethylamino)-2-phenylthio-2-butene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Bis(dimethylamino)-2-phenylthio-2-butene has 0 hydrogen bond donor(s) and 3 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 1,4-Bis(dimethylamino)-2-phenylthio-2-butene?
The CAS number of 1,4-Bis(dimethylamino)-2-phenylthio-2-butene is 64037-49-6.
What is the molecular formula of 1,4-Bis(dimethylamino)-2-phenylthio-2-butene?
The molecular formula of 1,4-Bis(dimethylamino)-2-phenylthio-2-butene is C14H22N2S.
What is the molecular weight of 1,4-Bis(dimethylamino)-2-phenylthio-2-butene?
The molecular weight of 1,4-Bis(dimethylamino)-2-phenylthio-2-butene is 250.15 g/mol.
Where can I buy 1,4-Bis(dimethylamino)-2-phenylthio-2-butene?
You can request a quote for 1,4-Bis(dimethylamino)-2-phenylthio-2-butene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Bis(dimethylamino)-2-phenylthio-2-butene?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Bis(dimethylamino)-2-phenylthio-2-butene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.