![2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid structure](/static/products/904/904010-50-0.png)
2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid
TL;DR: 2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid (CAS 904010-50-0) is a chemical compound with molecular formula C18H20N2O4S and molecular weight 360.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[benzyl(2-hydroxyethyl)carbamoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid
Also Known As: 2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid, 2-[[benzyl(2-hydroxyethyl)carbamoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid, 2-{[benzyl(2-hydroxyethyl)carbamoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid, 3-[(benzyl-(2-hydroxyethyl)carbamoyl)amino]-4-thiabicyclo[3.3.0]octa-2,9-diene-2-carboxylic Acid
| Molecular Formula | C18H20N2O4S |
|---|---|
| Molecular Weight | 360.11 g/mol |
| LogP | 2.9614 |
| Topological Polar Surface Area | 89.87 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 360.11438 |
| Heavy Atoms | 25 |
| Complexity | 772.8833 |
Chemical Identifiers
| CAS Number | 904010-50-0 |
|---|---|
| SMILES | C1CC2=C(C1)SC(=C2C(=O)O)NC(=O)N(CCO)CC3=CC=CC=C3 |
Product Overview
2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid (CAS 904010-50-0), with molecular formula C18H20N2O4S and molecular weight 360.11 g/mol. IUPAC: 2-[[benzyl(2-hydroxyethyl)carbamoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid.
Chemical Property Profile of 2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid
Property Insights of 2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid
The XLogP value of 2.9614 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid. The TPSA of 89.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid. Following Lipinski's Rule of Five, 2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid has 3 hydrogen bond donor(s) and 4 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 2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid?
The CAS number of 2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid is 904010-50-0.
What is the molecular formula of 2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid?
The molecular formula of 2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid is C18H20N2O4S.
What is the molecular weight of 2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid?
The molecular weight of 2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid is 360.11 g/mol.
Where can I buy 2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid?
You can request a quote for 2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-benzyl-3-(2-hydroxyethyl)ureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.