9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl-
TL;DR: 9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl- (CAS 69895-71-2) is a chemical compound with molecular formula C18H20N2O2S and molecular weight 328.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(2-hydroxyethylamino)ethylamino]-4-methylthioxanthen-9-one
Also Known As: Thioxanthen-9-one der., 1-({2-[(2-Hydroxyethyl)amino]ethyl}amino)-4-methyl-9H-thioxanthen-9-one, 1-[2-(2-hydroxyethylamino)ethylamino]-4-methylthioxanthen-9-, 9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl-, 1-[2-(2-hydroxyethylamino)ethylamino]-4-methyl-thioxanthen-9-one
| Molecular Formula | C18H20N2O2S |
|---|---|
| Molecular Weight | 328.12 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 86.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 328.12454 |
| Heavy Atoms | 23 |
| Complexity | 406.0 |
Chemical Identifiers
| CAS Number | 69895-71-2 |
|---|---|
| SMILES | CC1=C2C(=C(C=C1)NCCNCCO)C(=O)C3=CC=CC=C3S2 |
| InChIKey | QDICDDBHUNGLMP-UHFFFAOYSA-N |
Product Overview
9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl- (CAS 69895-71-2), with molecular formula C18H20N2O2S and molecular weight 328.12 g/mol. IUPAC: 1-[2-(2-hydroxyethylamino)ethylamino]-4-methylthioxanthen-9-one.
Chemical Property Profile of 9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl-
Property Insights of 9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl-. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl-. Following Lipinski's Rule of Five, 9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl- has 3 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 9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl-?
The CAS number of 9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl- is 69895-71-2.
What is the molecular formula of 9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl-?
The molecular formula of 9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl- is C18H20N2O2S.
What is the molecular weight of 9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl-?
The molecular weight of 9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl- is 328.12 g/mol.
Where can I buy 9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl-?
You can request a quote for 9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 9H-Thioxanthen-9-one, 1-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.