F0539-0892
TL;DR: F0539-0892 (CAS 449767-91-3) is a chemical compound with molecular formula C21H27N3O5S2 and molecular weight 465.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[4-(dimethylsulfamoyl)benzoyl]amino]-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
Also Known As: F0539-0892, methyl 2-(4-(N,N-dimethylsulfamoyl)benzamido)-6-isopropyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate, methyl 2-[[4-(dimethylsulfamoyl)benzoyl]amino]-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate, methyl 2-[4-(dimethylsulfamoyl)benzamido]-6-(propan-2-yl)-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate
| Molecular Formula | C21H27N3O5S2 |
|---|---|
| Molecular Weight | 465.14 g/mol |
| LogP | 2.8038 |
| Topological Polar Surface Area | 96.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 465.13922 |
| Heavy Atoms | 31 |
| Complexity | 1088.9636 |
Chemical Identifiers
| CAS Number | 449767-91-3 |
|---|---|
| SMILES | CC(C)N1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)C |
Product Overview
F0539-0892 (CAS 449767-91-3), with molecular formula C21H27N3O5S2 and molecular weight 465.14 g/mol. IUPAC: methyl 2-[[4-(dimethylsulfamoyl)benzoyl]amino]-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate.
Chemical Property Profile of F0539-0892
Property Insights of F0539-0892
The XLogP value of 2.8038 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0539-0892. The TPSA of 96.02 Ų falls within the moderate polarity range, balancing permeability and solubility for F0539-0892. Following Lipinski's Rule of Five, F0539-0892 has 1 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 F0539-0892?
The CAS number of F0539-0892 is 449767-91-3.
What is the molecular formula of F0539-0892?
The molecular formula of F0539-0892 is C21H27N3O5S2.
What is the molecular weight of F0539-0892?
The molecular weight of F0539-0892 is 465.14 g/mol.
Where can I buy F0539-0892?
You can request a quote for F0539-0892 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0539-0892?
Yes, KEHONG BIO provides custom synthesis services for F0539-0892 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.