Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine
TL;DR: Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine (CAS 27052-52-4) is a chemical compound with molecular formula C7H5N5S2 and molecular weight 223.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,10-dithia-2,4,12-triazatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8,11-pentaene-5,11-diamine
Also Known As: Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine, Dithiazolo[4,5-b:5 ,4 -e]pyridine-2,6-diamine, bis[1,3]thiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine, Bisthiazolo[4,5-b;5',4'-e]pyridine-2,6-diamine, BRD-K09913591-001-01-3
| Molecular Formula | C7H5N5S2 |
|---|---|
| Molecular Weight | 223.00 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 222.99864 |
| Heavy Atoms | 14 |
| Complexity | 218.0 |
Chemical Identifiers
| CAS Number | 27052-52-4 |
|---|---|
| SMILES | C1=C2C(=NC3=C1SC(=N3)N)N=C(S2)N |
| InChIKey | YEXRTWOVQNJHLF-UHFFFAOYSA-N |
Product Overview
Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine (CAS 27052-52-4), with molecular formula C7H5N5S2 and molecular weight 223.00 g/mol. IUPAC: 6,10-dithia-2,4,12-triazatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8,11-pentaene-5,11-diamine.
Chemical Property Profile of Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine
Property Insights of Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine. The TPSA of 147.0 Ų indicates high polarity, suggesting Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine has 2 hydrogen bond donor(s) and 7 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 Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine?
The CAS number of Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine is 27052-52-4.
What is the molecular formula of Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine?
The molecular formula of Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine is C7H5N5S2.
What is the molecular weight of Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine?
The molecular weight of Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine is 223.00 g/mol.
Where can I buy Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine?
You can request a quote for Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine?
Yes, KEHONG BIO provides custom synthesis services for Dithiazolo[4,5-b:5',4'-e]pyridine-2,6-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.