F1383-0037
TL;DR: F1383-0037 (CAS 685130-40-9) is a chemical compound with molecular formula C22H21F3N2O4S2 and molecular weight 498.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-methyl-2-[[2-[3-oxo-6-(trifluoromethyl)-4H-1,4-benzothiazin-2-yl]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: F1383-0037, methyl 6-methyl-2-{2-[3-oxo-6-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzothiazin-2-yl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, methyl 6-methyl-2-({[3-oxo-6-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzothiazin-2-yl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, methyl 6-methyl-2-[[2-[3-oxo-6-(trifluoromethyl)-4H-1,4-benzothiazin-2-yl]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, methyl 6-methyl-2-(2-(3-oxo-6-(trifluoromethyl)-3,4-dihydro-2H-benzo[b][1,4]thiazin-2-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
| Molecular Formula | C22H21F3N2O4S2 |
|---|---|
| Molecular Weight | 498.09 g/mol |
| LogP | 5.1199 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 498.08948 |
| Heavy Atoms | 33 |
| Complexity | 1129.5747 |
Chemical Identifiers
| CAS Number | 685130-40-9 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)CC3C(=O)NC4=C(S3)C=CC(=C4)C(F)(F)F |
Product Overview
F1383-0037 (CAS 685130-40-9), with molecular formula C22H21F3N2O4S2 and molecular weight 498.09 g/mol. IUPAC: methyl 6-methyl-2-[[2-[3-oxo-6-(trifluoromethyl)-4H-1,4-benzothiazin-2-yl]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of F1383-0037
Property Insights of F1383-0037
The XLogP value of 5.1199 indicates that F1383-0037 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 F1383-0037. Following Lipinski's Rule of Five, F1383-0037 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 F1383-0037?
The CAS number of F1383-0037 is 685130-40-9.
What is the molecular formula of F1383-0037?
The molecular formula of F1383-0037 is C22H21F3N2O4S2.
What is the molecular weight of F1383-0037?
The molecular weight of F1383-0037 is 498.09 g/mol.
Where can I buy F1383-0037?
You can request a quote for F1383-0037 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1383-0037?
Yes, KEHONG BIO provides custom synthesis services for F1383-0037 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.