F1830-0066
TL;DR: F1830-0066 (CAS 893096-96-3) is a chemical compound with molecular formula C18H18N2O4S and molecular weight 358.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[3-(methylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]carbamoyl]benzoate
Also Known As: F1830-0066, methyl 4-{[3-(methylcarbamoyl)-4H,5H,6H-cyclopenta[b]thiophen-2-yl]carbamoyl}benzoate, methyl 4-((3-(methylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl)benzoate, methyl 4-[[3-(methylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]carbamoyl]benzoate
| Molecular Formula | C18H18N2O4S |
|---|---|
| Molecular Weight | 358.10 g/mol |
| LogP | 2.6353 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.09872 |
| Heavy Atoms | 25 |
| Complexity | 839.5061 |
Chemical Identifiers
| CAS Number | 893096-96-3 |
|---|---|
| SMILES | CNC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC=C(C=C3)C(=O)OC |
Product Overview
F1830-0066 (CAS 893096-96-3), with molecular formula C18H18N2O4S and molecular weight 358.10 g/mol. IUPAC: methyl 4-[[3-(methylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]carbamoyl]benzoate.
Chemical Property Profile of F1830-0066
Property Insights of F1830-0066
The XLogP value of 2.6353 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1830-0066. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for F1830-0066. Following Lipinski's Rule of Five, F1830-0066 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 F1830-0066?
The CAS number of F1830-0066 is 893096-96-3.
What is the molecular formula of F1830-0066?
The molecular formula of F1830-0066 is C18H18N2O4S.
What is the molecular weight of F1830-0066?
The molecular weight of F1830-0066 is 358.10 g/mol.
Where can I buy F1830-0066?
You can request a quote for F1830-0066 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1830-0066?
Yes, KEHONG BIO provides custom synthesis services for F1830-0066 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.