ASN 14593820
TL;DR: ASN 14593820 (CAS 956791-98-3) is a chemical compound with molecular formula C16H18N4O3S and molecular weight 346.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-N-(3-methylphenyl)-3,8-dioxo-1-sulfanylidene-6,7-dihydropyrazolo[1,2-a][1,2,4]triazine-6-carboxamide
Also Known As: ASN 14593820, 4,4-dimethyl-N-(3-methylphenyl)-3,8-dioxo-1-sulfanyl-3,4,7,8-tetrahydro-6H-pyrazolo[1,2-a][1,2,4]triazine-6-carboxamide, AO-022/43453124, 1-mercapto-4,4-dimethyl-3,8-dioxo-N-(m-tolyl)-4,6,7,8-tetrahydro-3H-pyrazolo[1,2-a][1,2,4]triazine-6-carboxamide, 4,4-dimethyl-N-(3-methylphenyl)-3,8-dioxo-1-sulfanylidene-6,7-dihydropyrazolo[1,2-a][1,2,4]triazine-6-carboxamide
| Molecular Formula | C16H18N4O3S |
|---|---|
| Molecular Weight | 346.11 g/mol |
| LogP | 0.94472 |
| Topological Polar Surface Area | 81.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 346.10995 |
| Heavy Atoms | 24 |
| Complexity | 761.44434 |
Chemical Identifiers
| CAS Number | 956791-98-3 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)C2CC(=O)N3N2C(C(=O)NC3=S)(C)C |
Product Overview
ASN 14593820 (CAS 956791-98-3), with molecular formula C16H18N4O3S and molecular weight 346.11 g/mol. IUPAC: 4,4-dimethyl-N-(3-methylphenyl)-3,8-dioxo-1-sulfanylidene-6,7-dihydropyrazolo[1,2-a][1,2,4]triazine-6-carboxamide.
Chemical Property Profile of ASN 14593820
Property Insights of ASN 14593820
The XLogP value of 0.94472 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ASN 14593820. The TPSA of 81.75 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 14593820. Following Lipinski's Rule of Five, ASN 14593820 has 2 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 ASN 14593820?
The CAS number of ASN 14593820 is 956791-98-3.
What is the molecular formula of ASN 14593820?
The molecular formula of ASN 14593820 is C16H18N4O3S.
What is the molecular weight of ASN 14593820?
The molecular weight of ASN 14593820 is 346.11 g/mol.
Where can I buy ASN 14593820?
You can request a quote for ASN 14593820 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 14593820?
Yes, KEHONG BIO provides custom synthesis services for ASN 14593820 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.