![2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid structure](/static/products/903/903855-29-8.webp)
2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid
TL;DR: 2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid (CAS 903855-29-8) is a chemical compound with molecular formula C14H20N2O5S and molecular weight 328.10928 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[bis(2-hydroxyethyl)carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
Also Known As: 2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid, 2-[bis(2-hydroxyethyl)carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid, 2-[bis(2-hydroxyethyl)carbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid, 2-{[bis(2-hydroxyethyl)carbamoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
Technical Specifications
| Molecular Formula | C14H20N2O5S |
| Molecular Weight | 328.10928 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 138.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 328.10928 Da |
| Heavy Atoms | 22 |
| Complexity | 403.0 |
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)N(CCO)CCO)C(=O)O |
| InChIKey | LYEBIDPUTCTOFP-UHFFFAOYSA-N |
Chemical Property Profile of 2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid
Property Insights of 2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid. Following Lipinski's Rule of Five, 2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid?
The CAS number of 2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid is 903855-29-8.
What is the molecular formula of 2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid?
The molecular formula of 2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid is C14H20N2O5S.
What is the molecular weight of 2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid?
The molecular weight of 2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid is 328.10928 g/mol.
Where can I buy 2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid?
You can request a quote for 2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 2-(3,3-bis(2-hydroxyethyl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.