4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)-
TL;DR: 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)- (CAS 137731-08-9) is a chemical compound with molecular formula C11H10N4S and molecular weight 230.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methylsulfanyl-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepine
Also Known As: 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)-, 5-(Methylthio)-4H-(1,2,4)triazolo(4,3-a)(1,5)benzodiazepine, 5-methylsulfanyl-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepine, 5-(Methylsulfanyl)-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepine, 5-(Methylthio)-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepine
| Molecular Formula | C11H10N4S |
|---|---|
| Molecular Weight | 230.06 g/mol |
| LogP | 2.2164 |
| Topological Polar Surface Area | 43.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 230.06262 |
| Heavy Atoms | 16 |
| Complexity | 558.6171 |
Chemical Identifiers
| CAS Number | 137731-08-9 |
|---|---|
| SMILES | CSC1=NC2=CC=CC=C2N3C=NN=C3C1 |
Product Overview
4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)- (CAS 137731-08-9), with molecular formula C11H10N4S and molecular weight 230.06 g/mol. IUPAC: 5-methylsulfanyl-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepine.
Chemical Property Profile of 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)-
Property Insights of 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)-
The XLogP value of 2.2164 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)-. With a topological polar surface area (TPSA) of 43.07 Ų, 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)- has 0 hydrogen bond donor(s) and 4 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 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)-?
The CAS number of 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)- is 137731-08-9.
What is the molecular formula of 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)-?
The molecular formula of 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)- is C11H10N4S.
What is the molecular weight of 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)-?
The molecular weight of 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)- is 230.06 g/mol.
Where can I buy 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)-?
You can request a quote for 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)-?
Yes, KEHONG BIO provides custom synthesis services for 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(methylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.