F1751-0044
TL;DR: F1751-0044 (CAS 692759-84-5) is a chemical compound with molecular formula C25H30N2O4S2 and molecular weight 486.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-tert-butyl-2-[[2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: F1751-0044, ethyl 6-tert-butyl-2-[2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 6-(tert-butyl)-2-(2-(3-oxo-3,4-dihydro-2H-benzo[b][1,4]thiazin-2-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, ethyl 6-tert-butyl-2-[[2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 6-(tert-butyl)-2-[2-(3-oxo(2H,4H-benzo[e]1,4-thiazin-2-yl))acetylamino]- 4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
| Molecular Formula | C25H30N2O4S2 |
|---|---|
| Molecular Weight | 486.16 g/mol |
| LogP | 5.5174 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 486.1647 |
| Heavy Atoms | 33 |
| Complexity | 1086.5614 |
Chemical Identifiers
| CAS Number | 692759-84-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC(C2)C(C)(C)C)NC(=O)CC3C(=O)NC4=CC=CC=C4S3 |
Product Overview
F1751-0044 (CAS 692759-84-5), with molecular formula C25H30N2O4S2 and molecular weight 486.16 g/mol. IUPAC: ethyl 6-tert-butyl-2-[[2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of F1751-0044
Property Insights of F1751-0044
The XLogP value of 5.5174 indicates that F1751-0044 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for F1751-0044. Following Lipinski's Rule of Five, F1751-0044 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1751-0044?
The CAS number of F1751-0044 is 692759-84-5.
What is the molecular formula of F1751-0044?
The molecular formula of F1751-0044 is C25H30N2O4S2.
What is the molecular weight of F1751-0044?
The molecular weight of F1751-0044 is 486.16 g/mol.
Where can I buy F1751-0044?
You can request a quote for F1751-0044 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1751-0044?
Yes, KEHONG BIO provides custom synthesis services for F1751-0044 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.