F1359-1091
TL;DR: F1359-1091 (CAS 864977-06-0) is a chemical compound with molecular formula C16H15N3O6S3 and molecular weight 441.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(2-methoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]-5-nitrothiophene-2-carboxamide
Also Known As: F1359-1091, N-[(2Z)-6-methanesulfonyl-3-(2-methoxyethyl)-2,3-dihydro-1,3-benzothiazol-2-ylidene]-5-nitrothiophene-2-carboxamide, (Z)-N-(3-(2-methoxyethyl)-6-(methylsulfonyl)benzo[d]thiazol-2(3H)-ylidene)-5-nitrothiophene-2-carboxamide, N-[3-(2-methoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]-5-nitrothiophene-2-carboxamide, N-[3-(2-methoxyethyl)-6-methylsulfonyl-benzothiazol-2-ylidene]-5-nitro-thiophene-2-carboxamide
| Molecular Formula | C16H15N3O6S3 |
|---|---|
| Molecular Weight | 441.01 g/mol |
| LogP | 2.4635 |
| Topological Polar Surface Area | 120.87 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 441.0123 |
| Heavy Atoms | 28 |
| Complexity | 1236.0287 |
Chemical Identifiers
| CAS Number | 864977-06-0 |
|---|---|
| SMILES | COCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3=CC=C(S3)[N+](=O)[O-] |
Product Overview
F1359-1091 (CAS 864977-06-0), with molecular formula C16H15N3O6S3 and molecular weight 441.01 g/mol. IUPAC: N-[3-(2-methoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]-5-nitrothiophene-2-carboxamide.
Chemical Property Profile of F1359-1091
Property Insights of F1359-1091
The XLogP value of 2.4635 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1359-1091. The TPSA of 120.87 Ų falls within the moderate polarity range, balancing permeability and solubility for F1359-1091. Following Lipinski's Rule of Five, F1359-1091 has 0 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 F1359-1091?
The CAS number of F1359-1091 is 864977-06-0.
What is the molecular formula of F1359-1091?
The molecular formula of F1359-1091 is C16H15N3O6S3.
What is the molecular weight of F1359-1091?
The molecular weight of F1359-1091 is 441.01 g/mol.
Where can I buy F1359-1091?
You can request a quote for F1359-1091 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1359-1091?
Yes, KEHONG BIO provides custom synthesis services for F1359-1091 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.