BAS 04806941
TL;DR: BAS 04806941 (CAS 449175-86-4) is a chemical compound with molecular formula C17H14N2O5S2 and molecular weight 390.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Also Known As: BAS 04806941, N-(6-methanesulfonyl-1,3-benzothiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide, N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide, 2H,3H-benzo[e]1,4-dioxan-2-yl-N-[6-(methylsulfonyl)benzothiazol-2-yl]carboxami de, N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carboxamide
| Molecular Formula | C17H14N2O5S2 |
|---|---|
| Molecular Weight | 390.03 g/mol |
| LogP | 2.4783 |
| Topological Polar Surface Area | 94.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 390.03442 |
| Heavy Atoms | 26 |
| Complexity | 1107.2937 |
Chemical Identifiers
| CAS Number | 449175-86-4 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3COC4=CC=CC=C4O3 |
Product Overview
BAS 04806941 (CAS 449175-86-4), with molecular formula C17H14N2O5S2 and molecular weight 390.03 g/mol. IUPAC: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide.
Chemical Property Profile of BAS 04806941
Property Insights of BAS 04806941
The XLogP value of 2.4783 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04806941. The TPSA of 94.59 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04806941. Following Lipinski's Rule of Five, BAS 04806941 has 1 hydrogen bond donor(s) and 7 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 BAS 04806941?
The CAS number of BAS 04806941 is 449175-86-4.
What is the molecular formula of BAS 04806941?
The molecular formula of BAS 04806941 is C17H14N2O5S2.
What is the molecular weight of BAS 04806941?
The molecular weight of BAS 04806941 is 390.03 g/mol.
Where can I buy BAS 04806941?
You can request a quote for BAS 04806941 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04806941?
Yes, KEHONG BIO provides custom synthesis services for BAS 04806941 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.