![4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI) structure](/static/products/606/606487-19-8.png)
4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI)
TL;DR: 4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI) (CAS 606487-19-8) is a chemical compound with molecular formula C20H21N3O4S and molecular weight 399.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[2-[(4-methylphenyl)methylidene]hydrazinyl]-2-oxoacetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: 4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI), ethyl 2-[[2-[2-[(4-methylphenyl)methylidene]hydrazinyl]-2-oxoacetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
| Molecular Formula | C20H21N3O4S |
|---|---|
| Molecular Weight | 399.13 g/mol |
| LogP | 2.81072 |
| Topological Polar Surface Area | 96.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.12527 |
| Heavy Atoms | 28 |
| Complexity | 931.6726 |
Chemical Identifiers
| CAS Number | 606487-19-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C(=O)NN=CC3=CC=C(C=C3)C |
Product Overview
4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI) (CAS 606487-19-8), with molecular formula C20H21N3O4S and molecular weight 399.13 g/mol. IUPAC: ethyl 2-[[2-[2-[(4-methylphenyl)methylidene]hydrazinyl]-2-oxoacetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of 4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI)
Property Insights of 4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI)
The XLogP value of 2.81072 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI). The TPSA of 96.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI). Following Lipinski's Rule of Five, 4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI) has 2 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 4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI)?
The CAS number of 4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI) is 606487-19-8.
What is the molecular formula of 4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI)?
The molecular formula of 4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI) is C20H21N3O4S.
What is the molecular weight of 4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI)?
The molecular weight of 4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI) is 399.13 g/mol.
Where can I buy 4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI)?
You can request a quote for 4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI)?
Yes, KEHONG BIO provides custom synthesis services for 4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[[(4-methylphenyl)methylene]hydrazino]oxoacetyl]amino]-, ethyl ester (9CI) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.