9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene
TL;DR: 9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene (CAS 332898-75-6) is a chemical compound with molecular formula C18H21N5OS and molecular weight 355.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[(5-prop-2-enyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethyl]morpholine
Also Known As: BAS 01313699, 9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene, 4-[2-[(5-prop-2-enyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethyl]morpholine, 5-allyl-3-{[2-(4-morpholinyl)ethyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indole, 3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indole
| Molecular Formula | C18H21N5OS |
|---|---|
| Molecular Weight | 355.15 g/mol |
| LogP | 2.5898 |
| Topological Polar Surface Area | 56.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 355.14667 |
| Heavy Atoms | 25 |
| Complexity | 887.68536 |
Chemical Identifiers
| CAS Number | 332898-75-6 |
|---|---|
| SMILES | C=CCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCCN4CCOCC4 |
Product Overview
9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene (CAS 332898-75-6), with molecular formula C18H21N5OS and molecular weight 355.15 g/mol. IUPAC: 4-[2-[(5-prop-2-enyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethyl]morpholine.
Chemical Property Profile of 9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene
Property Insights of 9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene
The XLogP value of 2.5898 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene. With a topological polar surface area (TPSA) of 56.07 Ų, 9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene has 0 hydrogen bond donor(s) and 6 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 9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene?
The CAS number of 9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene is 332898-75-6.
What is the molecular formula of 9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene?
The molecular formula of 9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene is C18H21N5OS.
What is the molecular weight of 9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene?
The molecular weight of 9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene is 355.15 g/mol.
Where can I buy 9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene?
You can request a quote for 9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene?
Yes, KEHONG BIO provides custom synthesis services for 9-Allyl-2-(2-morpholin-4-yl-ethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.