ASN 06897685
TL;DR: ASN 06897685 (CAS 606117-98-0) is a chemical compound with molecular formula C12H17N5OS2 and molecular weight 311.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-tert-butyl-1-methyl-N-(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)pyrazole-5-carboxamide
Also Known As: ASN 06897685, 5-tert-butyl-2-methyl-N-(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)pyrazole-3-carboxamide, 1H-PYRAZOLE-5-CARBOXAMIDE, 3-(1,1-DIMETHYLETHYL)-1-METHYL-N-[3-(METHYLTHIO)-1,2,4-THIADIAZOL-5-YL]-, 1H-Pyrazole-5-carboxamide, 3-(1,1-dimethylethyl)-1-methyl-N-[3-(methylthio)-1,2,4-thiadiazol-5-yl]- (9CI)
| Molecular Formula | C12H17N5OS2 |
|---|---|
| Molecular Weight | 311.09 g/mol |
| LogP | 2.5433 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 311.08746 |
| Heavy Atoms | 20 |
| Complexity | 626.0715 |
Chemical Identifiers
| CAS Number | 606117-98-0 |
|---|---|
| SMILES | CC(C)(C)C1=NN(C(=C1)C(=O)NC2=NC(=NS2)SC)C |
Product Overview
ASN 06897685 (CAS 606117-98-0), with molecular formula C12H17N5OS2 and molecular weight 311.09 g/mol. IUPAC: 3-tert-butyl-1-methyl-N-(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)pyrazole-5-carboxamide.
Chemical Property Profile of ASN 06897685
Property Insights of ASN 06897685
The XLogP value of 2.5433 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ASN 06897685. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 06897685. Following Lipinski's Rule of Five, ASN 06897685 has 1 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 ASN 06897685?
The CAS number of ASN 06897685 is 606117-98-0.
What is the molecular formula of ASN 06897685?
The molecular formula of ASN 06897685 is C12H17N5OS2.
What is the molecular weight of ASN 06897685?
The molecular weight of ASN 06897685 is 311.09 g/mol.
Where can I buy ASN 06897685?
You can request a quote for ASN 06897685 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 06897685?
Yes, KEHONG BIO provides custom synthesis services for ASN 06897685 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.