LY 193239
TL;DR: LY 193239 (CAS 124986-46-5) is a chemical compound with molecular formula C14H16N6O7S2 and molecular weight 444.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-6-methylsulfonyl-3-oxo-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5-carboxylic acid
Also Known As: LY 193239, (2S)-2-[[(2Z)-2-(2-Amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-6-methylsulfonyl-3-oxo-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5-carboxylic acid, 2-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-6-methylsulfonyl-3-oxo-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5-carboxylic acid, 1H,5H-Pyrazolo(1,2-a)pyrazole-3-carboxylic acid, 6-(((2-amino-4-thiazolyl)(methoxyimino)acetyl)amino)-6,7-dihydro-2- (methylsulfonyl)-5-oxo-, (S-(Z))-, 1H,5H-Pyrazolo(1,2-a)pyrazole-3-carboxylic acid, 6-(((2-amino-4-thiazolyl)(methoxyimino)acetyl)amino)-6,7-dihydro-2-(methylsulfonyl)-5-oxo-, (Z)-
| Molecular Formula | C14H16N6O7S2 |
|---|---|
| Molecular Weight | 444.05 g/mol |
| LogP | -2.0258 |
| Topological Polar Surface Area | 184.59 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 444.0522 |
| Heavy Atoms | 29 |
| Complexity | 1060.2673 |
Chemical Identifiers
| CAS Number | 124986-46-5 |
|---|---|
| SMILES | CO/N=C(\C1=CSC(=N1)N)/C(=O)NC2CN3CC(=C(N3C2=O)C(=O)O)S(=O)(=O)C |
Product Overview
LY 193239 (CAS 124986-46-5), with molecular formula C14H16N6O7S2 and molecular weight 444.05 g/mol. IUPAC: 2-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-6-methylsulfonyl-3-oxo-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5-carboxylic acid.
Chemical Property Profile of LY 193239
Property Insights of LY 193239
The XLogP value of -2.0258 indicates that LY 193239 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 184.59 Ų indicates high polarity, suggesting LY 193239 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, LY 193239 has 3 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of LY 193239?
The CAS number of LY 193239 is 124986-46-5.
What is the molecular formula of LY 193239?
The molecular formula of LY 193239 is C14H16N6O7S2.
What is the molecular weight of LY 193239?
The molecular weight of LY 193239 is 444.05 g/mol.
Where can I buy LY 193239?
You can request a quote for LY 193239 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for LY 193239?
Yes, KEHONG BIO provides custom synthesis services for LY 193239 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.