F1366-2971
TL;DR: F1366-2971 (CAS 865247-98-9) is a chemical compound with molecular formula C20H19N3O7S2 and molecular weight 477.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[3-(2-ethoxy-2-oxoethyl)-6-sulfamoyl-1,3-benzothiazol-2-ylidene]carbamoyl]benzoate
Also Known As: F1366-2971, (Z)-methyl 4-((3-(2-ethoxy-2-oxoethyl)-6-sulfamoylbenzo[d]thiazol-2(3H)-ylidene)carbamoyl)benzoate, methyl 4-{[(2Z)-3-(2-ethoxy-2-oxoethyl)-6-sulfamoyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]carbamoyl}benzoate, methyl 4-[[3-(2-ethoxy-2-oxoethyl)-6-sulfamoyl-1,3-benzothiazol-2-ylidene]carbamoyl]benzoate, Methyl 4-[[3-(ethoxycarbonylmethyl)-6-sulfamoyl-benzothiazol-2-ylidene]carbamoyl]benzoate
| Molecular Formula | C20H19N3O7S2 |
|---|---|
| Molecular Weight | 477.07 g/mol |
| LogP | 1.441 |
| Topological Polar Surface Area | 147.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 477.06644 |
| Heavy Atoms | 32 |
| Complexity | 1370.4343 |
Chemical Identifiers
| CAS Number | 865247-98-9 |
|---|---|
| SMILES | CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N)SC1=NC(=O)C3=CC=C(C=C3)C(=O)OC |
Product Overview
F1366-2971 (CAS 865247-98-9), with molecular formula C20H19N3O7S2 and molecular weight 477.07 g/mol. IUPAC: methyl 4-[[3-(2-ethoxy-2-oxoethyl)-6-sulfamoyl-1,3-benzothiazol-2-ylidene]carbamoyl]benzoate.
Chemical Property Profile of F1366-2971
Property Insights of F1366-2971
The XLogP value of 1.441 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1366-2971. The TPSA of 147.12 Ų indicates high polarity, suggesting F1366-2971 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F1366-2971 has 1 hydrogen bond donor(s) and 8 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 F1366-2971?
The CAS number of F1366-2971 is 865247-98-9.
What is the molecular formula of F1366-2971?
The molecular formula of F1366-2971 is C20H19N3O7S2.
What is the molecular weight of F1366-2971?
The molecular weight of F1366-2971 is 477.07 g/mol.
Where can I buy F1366-2971?
You can request a quote for F1366-2971 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1366-2971?
Yes, KEHONG BIO provides custom synthesis services for F1366-2971 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.