F0539-2091
TL;DR: F0539-2091 (CAS 489471-17-2) is a chemical compound with molecular formula C24H31N3O5S2 and molecular weight 505.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5,5,7,7-tetramethyl-2-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]-4,6-dihydrothieno[2,3-c]pyridine-3-carboxylate
Also Known As: F0539-2091, methyl 5,5,7,7-tetramethyl-2-(4-(pyrrolidin-1-ylsulfonyl)benzamido)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate, methyl 5,5,7,7-tetramethyl-2-[4-(pyrrolidine-1-sulfonyl)benzamido]-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate, methyl 5,5,7,7-tetramethyl-2-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]-4,6-dihydrothieno[2,3-c]pyridine-3-carboxylate
| Molecular Formula | C24H31N3O5S2 |
|---|---|
| Molecular Weight | 505.17 g/mol |
| LogP | 3.7309 |
| Topological Polar Surface Area | 104.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 505.1705 |
| Heavy Atoms | 34 |
| Complexity | 1224.0448 |
Chemical Identifiers
| CAS Number | 489471-17-2 |
|---|---|
| SMILES | CC1(CC2=C(C(N1)(C)C)SC(=C2C(=O)OC)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C |
Product Overview
F0539-2091 (CAS 489471-17-2), with molecular formula C24H31N3O5S2 and molecular weight 505.17 g/mol. IUPAC: methyl 5,5,7,7-tetramethyl-2-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]-4,6-dihydrothieno[2,3-c]pyridine-3-carboxylate.
Chemical Property Profile of F0539-2091
Property Insights of F0539-2091
The XLogP value of 3.7309 indicates that F0539-2091 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.81 Ų falls within the moderate polarity range, balancing permeability and solubility for F0539-2091. Following Lipinski's Rule of Five, F0539-2091 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0539-2091?
The CAS number of F0539-2091 is 489471-17-2.
What is the molecular formula of F0539-2091?
The molecular formula of F0539-2091 is C24H31N3O5S2.
What is the molecular weight of F0539-2091?
The molecular weight of F0539-2091 is 505.17 g/mol.
Where can I buy F0539-2091?
You can request a quote for F0539-2091 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0539-2091?
Yes, KEHONG BIO provides custom synthesis services for F0539-2091 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.