ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate
TL;DR: ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate (CAS 394228-08-1) is a chemical compound with molecular formula C20H25N3O5S2 and molecular weight 451.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3,4-dimethyl-2-(4-piperidin-1-ylsulfonylbenzoyl)imino-1,3-thiazole-5-carboxylate
Also Known As: ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate, F0737-0412, ethyl 3,4-dimethyl-2-(4-piperidin-1-ylsulfonylbenzoyl)imino-1,3-thiazole-5-carboxylate, (Z)-ethyl 3,4-dimethyl-2-((4-(piperidin-1-ylsulfonyl)benzoyl)imino)-2,3-dihydrothiazole-5-carboxylate, Ethyl 3,4-dimethyl-2-[4-(1-piperidylsulfonyl)benzoyl]imino-1,3-thiazole-5-carboxylate
| Molecular Formula | C20H25N3O5S2 |
|---|---|
| Molecular Weight | 451.12 g/mol |
| LogP | 2.48742 |
| Topological Polar Surface Area | 98.04 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 451.12357 |
| Heavy Atoms | 30 |
| Complexity | 1108.301 |
Chemical Identifiers
| CAS Number | 394228-08-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C(=NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)S1)C)C |
Product Overview
ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate (CAS 394228-08-1), with molecular formula C20H25N3O5S2 and molecular weight 451.12 g/mol. IUPAC: ethyl 3,4-dimethyl-2-(4-piperidin-1-ylsulfonylbenzoyl)imino-1,3-thiazole-5-carboxylate.
Chemical Property Profile of ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate
Property Insights of ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate
The XLogP value of 2.48742 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate. The TPSA of 98.04 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate. Following Lipinski's Rule of Five, ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate has 0 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 ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate?
The CAS number of ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate is 394228-08-1.
What is the molecular formula of ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate?
The molecular formula of ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate is C20H25N3O5S2.
What is the molecular weight of ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate?
The molecular weight of ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate is 451.12 g/mol.
Where can I buy ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate?
You can request a quote for ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl (2Z)-3,4-dimethyl-2-{[4-(piperidine-1-sulfonyl)benzoyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.