![1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide structure](/static/products/5239/523991-45-9.webp)
1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide
TL;DR: 1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide (CAS 523991-45-9) is a chemical compound with molecular formula C19H20F3N5O3S and molecular weight 455.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(Z)-3-[amino(1,3-benzothiazol-2-yl)carbamoyl]-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide
Also Known As: 1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide, (Z)-1-(3-(1-(benzo[d]thiazol-2-yl)hydrazinecarbonyl)-5,5,5-trifluoro-4-oxopent-2-en-2-yl)piperidine-4-carboxamide, 1-[(1Z)-2-(N-amino-N-benzothiazol-2-ylcarbamoyl)-4,4,4-trifluoro-1-methyl-3-ox obut-1-enyl]piperidine-4-carboxamide, 1-[(Z)-3-[amino(1,3-benzothiazol-2-yl)carbamoyl]-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide
| Molecular Formula | C19H20F3N5O3S |
|---|---|
| Molecular Weight | 455.12 g/mol |
| LogP | 2.1057 |
| Topological Polar Surface Area | 122.62 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 455.1239 |
| Heavy Atoms | 31 |
| Complexity | 1024.4808 |
Chemical Identifiers
| CAS Number | 523991-45-9 |
|---|---|
| SMILES | C/C(=C(\C(=O)C(F)(F)F)/C(=O)N(C1=NC2=CC=CC=C2S1)N)/N3CCC(CC3)C(=O)N |
Product Overview
1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide (CAS 523991-45-9), with molecular formula C19H20F3N5O3S and molecular weight 455.12 g/mol. IUPAC: 1-[(Z)-3-[amino(1,3-benzothiazol-2-yl)carbamoyl]-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide.
Chemical Property Profile of 1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide
Property Insights of 1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide
The XLogP value of 2.1057 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide. The TPSA of 122.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide. Following Lipinski's Rule of Five, 1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide has 2 hydrogen bond donor(s) and 7 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 1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide?
The CAS number of 1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide is 523991-45-9.
What is the molecular formula of 1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide?
The molecular formula of 1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide is C19H20F3N5O3S.
What is the molecular weight of 1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide?
The molecular weight of 1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide is 455.12 g/mol.
Where can I buy 1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide?
You can request a quote for 1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2Z)-3-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5,5,5-trifluoro-4-oxopent-2-en-2-yl]piperidine-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.