5-[(6-Ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid
TL;DR: 5-[(6-Ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid (CAS 392236-03-2) is a chemical compound with molecular formula C14H16N2O4S and molecular weight 308.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid
Also Known As: BAS 00668119, 5-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid, 4-(6-Ethoxy-benzothiazol-2-ylcarbamoyl)-butyric acid, 4-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamoyl]butanoic acid, 5-((6-ethoxybenzo[d]thiazol-2-yl)amino)-5-oxopentanoic acid
| Molecular Formula | C14H16N2O4S |
|---|---|
| Molecular Weight | 308.08 g/mol |
| LogP | 2.8884 |
| Topological Polar Surface Area | 88.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 308.08307 |
| Heavy Atoms | 21 |
| Complexity | 653.4615 |
Chemical Identifiers
| CAS Number | 392236-03-2 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCC(=O)O |
Product Overview
5-[(6-Ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid (CAS 392236-03-2), with molecular formula C14H16N2O4S and molecular weight 308.08 g/mol. IUPAC: 5-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid.
Chemical Property Profile of 5-[(6-Ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid
Property Insights of 5-[(6-Ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid
The XLogP value of 2.8884 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(6-Ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid. The TPSA of 88.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(6-Ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid. Following Lipinski's Rule of Five, 5-[(6-Ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid 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 5-[(6-Ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid?
The CAS number of 5-[(6-Ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid is 392236-03-2.
What is the molecular formula of 5-[(6-Ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid?
The molecular formula of 5-[(6-Ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid is C14H16N2O4S.
What is the molecular weight of 5-[(6-Ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid?
The molecular weight of 5-[(6-Ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid is 308.08 g/mol.
Where can I buy 5-[(6-Ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid?
You can request a quote for 5-[(6-Ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(6-Ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-[(6-Ethoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.