1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea
TL;DR: 1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea (CAS 903855-83-4) is a chemical compound with molecular formula C18H19N3O2S and molecular weight 341.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea
Also Known As: 1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea
| Molecular Formula | C18H19N3O2S |
|---|---|
| Molecular Weight | 341.12 g/mol |
| LogP | 3.13488 |
| Topological Polar Surface Area | 76.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 341.1198 |
| Heavy Atoms | 24 |
| Complexity | 764.56134 |
Chemical Identifiers
| CAS Number | 903855-83-4 |
|---|---|
| SMILES | C1CC2=C(C1)SC(=C2C#N)NC(=O)N(CCO)CC3=CC=CC=C3 |
Product Overview
1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea (CAS 903855-83-4), with molecular formula C18H19N3O2S and molecular weight 341.12 g/mol. IUPAC: 1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea.
Chemical Property Profile of 1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea
Property Insights of 1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea
The XLogP value of 3.13488 indicates that 1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea. Following Lipinski's Rule of Five, 1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea has 2 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 1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea?
The CAS number of 1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea is 903855-83-4.
What is the molecular formula of 1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea?
The molecular formula of 1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea is C18H19N3O2S.
What is the molecular weight of 1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea?
The molecular weight of 1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea is 341.12 g/mol.
Where can I buy 1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea?
You can request a quote for 1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-benzyl-3-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-(2-hydroxyethyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.