![(Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate structure](/static/products/488/488088-99-9.png)
(Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate
TL;DR: (Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate (CAS 488088-99-9) is a chemical compound with molecular formula C28H22N2O5S2 and molecular weight 530.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2Z)-5-amino-6-(benzenesulfonyl)-2-benzylidene-3-oxo-7-phenyl-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate
Also Known As: (Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate, methyl (2Z)-5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate, methyl (2Z)-5-amino-6-(benzenesulfonyl)-2-benzylidene-3-oxo-7-phenyl-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate
| Molecular Formula | C28H22N2O5S2 |
|---|---|
| Molecular Weight | 530.10 g/mol |
| LogP | 2.4184 |
| Topological Polar Surface Area | 108.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 530.097 |
| Heavy Atoms | 37 |
| Complexity | 1806.0854 |
Chemical Identifiers
| CAS Number | 488088-99-9 |
|---|---|
| SMILES | COC(=O)C1=C2N(C(=C(C1C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)N)C(=O)/C(=C/C5=CC=CC=C5)/S2 |
Product Overview
(Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate (CAS 488088-99-9), with molecular formula C28H22N2O5S2 and molecular weight 530.10 g/mol. IUPAC: methyl (2Z)-5-amino-6-(benzenesulfonyl)-2-benzylidene-3-oxo-7-phenyl-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate.
Chemical Property Profile of (Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate
Property Insights of (Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate
The XLogP value of 2.4184 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate. The TPSA of 108.46 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate. Following Lipinski's Rule of Five, (Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate?
The CAS number of (Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate is 488088-99-9.
What is the molecular formula of (Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate?
The molecular formula of (Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate is C28H22N2O5S2.
What is the molecular weight of (Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate?
The molecular weight of (Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate is 530.10 g/mol.
Where can I buy (Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate?
You can request a quote for (Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-methyl 5-amino-2-benzylidene-3-oxo-7-phenyl-6-(phenylsulfonyl)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.