![5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid structure](/static/products/4450/445021-77-2.webp)
5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid
TL;DR: 5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid (CAS 445021-77-2) is a chemical compound with molecular formula C23H35NO5S and molecular weight 437.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid
Also Known As: 5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid, 5-oxo-5-{[3-(propoxycarbonyl)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl]amino}pentanoic acid, 4-{[3-(PROPOXYCARBONYL)-4H,5H,6H,7H,8H,9H,10H,11H,12H,13H-CYCLODODECA[B]THIOPHEN-2-YL]CARBAMOYL}BUTANOIC ACID, 4-{N-[3-(propoxycarbonyl)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[2,1-d]t hiophen-2-yl]carbamoyl}butanoic acid, 5-oxo-5-((3-(propoxycarbonyl)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino)pentanoic acid
| Molecular Formula | C23H35NO5S |
|---|---|
| Molecular Weight | 437.22 g/mol |
| LogP | 5.7277 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 437.2236 |
| Heavy Atoms | 30 |
| Complexity | 712.6918 |
Chemical Identifiers
| CAS Number | 445021-77-2 |
|---|---|
| SMILES | CCCOC(=O)C1=C(SC2=C1CCCCCCCCCC2)NC(=O)CCCC(=O)O |
Product Overview
5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid (CAS 445021-77-2), with molecular formula C23H35NO5S and molecular weight 437.22 g/mol. IUPAC: 5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid.
Chemical Property Profile of 5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid
Property Insights of 5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid
The XLogP value of 5.7277 indicates that 5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid. Following Lipinski's Rule of Five, 5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid?
The CAS number of 5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid is 445021-77-2.
What is the molecular formula of 5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid?
The molecular formula of 5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid is C23H35NO5S.
What is the molecular weight of 5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid?
The molecular weight of 5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid is 437.22 g/mol.
Where can I buy 5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid?
You can request a quote for 5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-oxo-5-[(3-propoxycarbonyl-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)amino]pentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.