1,4-Dimorpholino-2-(phenylthio)-2-butene
TL;DR: 1,4-Dimorpholino-2-(phenylthio)-2-butene (CAS 64037-55-4) is a chemical compound with molecular formula C18H26N2O2S and molecular weight 334.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-morpholin-4-yl-2-phenylsulfanylbut-2-enyl)morpholine
Also Known As: 1,4-dimorpholino-2-2-butene, 1,4-Dimorpholino-2-(phenylthio)-2-butene
| Molecular Formula | C18H26N2O2S |
|---|---|
| Molecular Weight | 334.17 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 50.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 334.1715 |
| Heavy Atoms | 23 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 64037-55-4 |
|---|---|
| SMILES | C1COCCN1CC=C(CN2CCOCC2)SC3=CC=CC=C3 |
| InChIKey | ZOMHQIPVPLKQBW-UHFFFAOYSA-N |
Product Overview
1,4-Dimorpholino-2-(phenylthio)-2-butene (CAS 64037-55-4), with molecular formula C18H26N2O2S and molecular weight 334.17 g/mol. IUPAC: 4-(4-morpholin-4-yl-2-phenylsulfanylbut-2-enyl)morpholine.
Chemical Property Profile of 1,4-Dimorpholino-2-(phenylthio)-2-butene
Property Insights of 1,4-Dimorpholino-2-(phenylthio)-2-butene
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Dimorpholino-2-(phenylthio)-2-butene. With a topological polar surface area (TPSA) of 50.2 Ų, 1,4-Dimorpholino-2-(phenylthio)-2-butene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dimorpholino-2-(phenylthio)-2-butene 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 1,4-Dimorpholino-2-(phenylthio)-2-butene?
The CAS number of 1,4-Dimorpholino-2-(phenylthio)-2-butene is 64037-55-4.
What is the molecular formula of 1,4-Dimorpholino-2-(phenylthio)-2-butene?
The molecular formula of 1,4-Dimorpholino-2-(phenylthio)-2-butene is C18H26N2O2S.
What is the molecular weight of 1,4-Dimorpholino-2-(phenylthio)-2-butene?
The molecular weight of 1,4-Dimorpholino-2-(phenylthio)-2-butene is 334.17 g/mol.
Where can I buy 1,4-Dimorpholino-2-(phenylthio)-2-butene?
You can request a quote for 1,4-Dimorpholino-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-Dimorpholino-2-(phenylthio)-2-butene?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dimorpholino-2-(phenylthio)-2-butene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.