F1105-0459
TL;DR: F1105-0459 (CAS 442556-75-4) is a chemical compound with molecular formula C18H16N2O5S2 and molecular weight 404.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Also Known As: F1105-0459, (Z)-N-(3-methyl-6-(methylsulfonyl)benzo[d]thiazol-2(3H)-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carboxamide, N-[(2Z)-6-methanesulfonyl-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carboxamide, N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-2,3-dihydro-1,4-benzodioxine-3-carboxamide, N-(3-Methyl-6-(methylsulfonyl)benzo[d]thiazol-2(3H)-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carboxamide
| Molecular Formula | C18H16N2O5S2 |
|---|---|
| Molecular Weight | 404.05 g/mol |
| LogP | 1.9106 |
| Topological Polar Surface Area | 86.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 404.05005 |
| Heavy Atoms | 27 |
| Complexity | 1224.023 |
Chemical Identifiers
| CAS Number | 442556-75-4 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3COC4=CC=CC=C4O3 |
Product Overview
F1105-0459 (CAS 442556-75-4), with molecular formula C18H16N2O5S2 and molecular weight 404.05 g/mol. IUPAC: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-2,3-dihydro-1,4-benzodioxine-3-carboxamide.
Chemical Property Profile of F1105-0459
Property Insights of F1105-0459
The XLogP value of 1.9106 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1105-0459. The TPSA of 86.96 Ų falls within the moderate polarity range, balancing permeability and solubility for F1105-0459. Following Lipinski's Rule of Five, F1105-0459 has 0 hydrogen bond donor(s) and 6 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 F1105-0459?
The CAS number of F1105-0459 is 442556-75-4.
What is the molecular formula of F1105-0459?
The molecular formula of F1105-0459 is C18H16N2O5S2.
What is the molecular weight of F1105-0459?
The molecular weight of F1105-0459 is 404.05 g/mol.
Where can I buy F1105-0459?
You can request a quote for F1105-0459 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1105-0459?
Yes, KEHONG BIO provides custom synthesis services for F1105-0459 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.