F1105-0406
TL;DR: F1105-0406 (CAS 683237-90-3) is a chemical compound with molecular formula C22H25N3O5S3 and molecular weight 507.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(azepan-1-ylsulfonyl)-N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)benzamide
Also Known As: F1105-0406, 4-(azepane-1-sulfonyl)-N-[(2Z)-6-methanesulfonyl-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]benzamide, 4-(azepan-1-ylsulfonyl)-N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)benzamide, (Z)-4-(azepan-1-ylsulfonyl)-N-(3-methyl-6-(methylsulfonyl)benzo[d]thiazol-2(3H)-ylidene)benzamide, 4-(azepan-1-ylsulfonyl)-N-(3-methyl-6-methylsulfonyl-benzothiazol-2-ylidene)benzamide
| Molecular Formula | C22H25N3O5S3 |
|---|---|
| Molecular Weight | 507.10 g/mol |
| LogP | 2.9491 |
| Topological Polar Surface Area | 105.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 507.09564 |
| Heavy Atoms | 33 |
| Complexity | 1476.2542 |
Chemical Identifiers
| CAS Number | 683237-90-3 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4 |
Product Overview
F1105-0406 (CAS 683237-90-3), with molecular formula C22H25N3O5S3 and molecular weight 507.10 g/mol. IUPAC: 4-(azepan-1-ylsulfonyl)-N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)benzamide.
Chemical Property Profile of F1105-0406
Property Insights of F1105-0406
The XLogP value of 2.9491 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1105-0406. The TPSA of 105.88 Ų falls within the moderate polarity range, balancing permeability and solubility for F1105-0406. Following Lipinski's Rule of Five, F1105-0406 has 0 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 F1105-0406?
The CAS number of F1105-0406 is 683237-90-3.
What is the molecular formula of F1105-0406?
The molecular formula of F1105-0406 is C22H25N3O5S3.
What is the molecular weight of F1105-0406?
The molecular weight of F1105-0406 is 507.10 g/mol.
Where can I buy F1105-0406?
You can request a quote for F1105-0406 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1105-0406?
Yes, KEHONG BIO provides custom synthesis services for F1105-0406 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.