F1450-0201
TL;DR: F1450-0201 (CAS 468747-39-9) is a chemical compound with molecular formula C16H19NO5S and molecular weight 337.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3-methyl-4-oxobut-2-enoic acid
Also Known As: F1450-0201, (2E)-3-{[3-(ethoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}-3-methylprop-2-enoic acid, (E)-4-((3-(ethoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-3-methyl-4-oxobut-2-enoic acid, (E)-4-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3-methyl-4-oxobut-2-enoic acid, 3-[(3-ethoxycarbonyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamoyl]but-2-enoic Acid
| Molecular Formula | C16H19NO5S |
|---|---|
| Molecular Weight | 337.10 g/mol |
| LogP | 2.773 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 337.0984 |
| Heavy Atoms | 23 |
| Complexity | 674.2556 |
Chemical Identifiers
| CAS Number | 468747-39-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)/C(=C/C(=O)O)/C |
Product Overview
F1450-0201 (CAS 468747-39-9), with molecular formula C16H19NO5S and molecular weight 337.10 g/mol. IUPAC: (E)-4-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3-methyl-4-oxobut-2-enoic acid.
Chemical Property Profile of F1450-0201
Property Insights of F1450-0201
The XLogP value of 2.773 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1450-0201. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for F1450-0201. Following Lipinski's Rule of Five, F1450-0201 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 F1450-0201?
The CAS number of F1450-0201 is 468747-39-9.
What is the molecular formula of F1450-0201?
The molecular formula of F1450-0201 is C16H19NO5S.
What is the molecular weight of F1450-0201?
The molecular weight of F1450-0201 is 337.10 g/mol.
Where can I buy F1450-0201?
You can request a quote for F1450-0201 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1450-0201?
Yes, KEHONG BIO provides custom synthesis services for F1450-0201 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.