F2590-0468
TL;DR: F2590-0468 (CAS 896306-61-9) is a chemical compound with molecular formula C18H18N2O6S and molecular weight 390.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[3-(methoxycarbonylcarbamoyl)-4,5-dimethylthiophen-2-yl]carbamoyl]benzoate
Also Known As: F2590-0468, methyl 4-((3-((methoxycarbonyl)carbamoyl)-4,5-dimethylthiophen-2-yl)carbamoyl)benzoate, methyl 4-[(3-{[(methoxycarbonyl)amino]carbonyl}-4,5-dimethylthiophen-2-yl)carbamoyl]benzoate, methyl 4-[[3-(methoxycarbonylcarbamoyl)-4,5-dimethylthiophen-2-yl]carbamoyl]benzoate
| Molecular Formula | C18H18N2O6S |
|---|---|
| Molecular Weight | 390.09 g/mol |
| LogP | 2.90004 |
| Topological Polar Surface Area | 110.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 390.08856 |
| Heavy Atoms | 27 |
| Complexity | 901.3208 |
Chemical Identifiers
| CAS Number | 896306-61-9 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)NC(=O)OC)NC(=O)C2=CC=C(C=C2)C(=O)OC)C |
Product Overview
F2590-0468 (CAS 896306-61-9), with molecular formula C18H18N2O6S and molecular weight 390.09 g/mol. IUPAC: methyl 4-[[3-(methoxycarbonylcarbamoyl)-4,5-dimethylthiophen-2-yl]carbamoyl]benzoate.
Chemical Property Profile of F2590-0468
Property Insights of F2590-0468
The XLogP value of 2.90004 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2590-0468. The TPSA of 110.8 Ų falls within the moderate polarity range, balancing permeability and solubility for F2590-0468. Following Lipinski's Rule of Five, F2590-0468 has 2 hydrogen bond donor(s) and 7 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 F2590-0468?
The CAS number of F2590-0468 is 896306-61-9.
What is the molecular formula of F2590-0468?
The molecular formula of F2590-0468 is C18H18N2O6S.
What is the molecular weight of F2590-0468?
The molecular weight of F2590-0468 is 390.09 g/mol.
Where can I buy F2590-0468?
You can request a quote for F2590-0468 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2590-0468?
Yes, KEHONG BIO provides custom synthesis services for F2590-0468 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.