BAS 06741900
TL;DR: BAS 06741900 (CAS 445265-09-8) is a chemical compound with molecular formula C18H16N2O4S and molecular weight 356.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-1,1-dioxo-1,2-benzothiazol-3-one
Also Known As: BAS 06741900, AL-383/41206044, 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-1,1-dioxo-1,2-benzothiazol-3-one, 2-[2-(3,4-dihydro-2(1H)-isoquinolinyl)-2-oxoethyl]-1,2-benzisothiazol-3(2H)-one 1,1-dioxide, 2-(2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide
| Molecular Formula | C18H16N2O4S |
|---|---|
| Molecular Weight | 356.08 g/mol |
| LogP | 1.416 |
| Topological Polar Surface Area | 74.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 356.08307 |
| Heavy Atoms | 25 |
| Complexity | 984.0755 |
Chemical Identifiers
| CAS Number | 445265-09-8 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)C(=O)CN3C(=O)C4=CC=CC=C4S3(=O)=O |
Product Overview
BAS 06741900 (CAS 445265-09-8), with molecular formula C18H16N2O4S and molecular weight 356.08 g/mol. IUPAC: 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-1,1-dioxo-1,2-benzothiazol-3-one.
Chemical Property Profile of BAS 06741900
Property Insights of BAS 06741900
The XLogP value of 1.416 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 06741900. The TPSA of 74.76 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06741900. Following Lipinski's Rule of Five, BAS 06741900 has 0 hydrogen bond donor(s) and 4 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 06741900?
The CAS number of BAS 06741900 is 445265-09-8.
What is the molecular formula of BAS 06741900?
The molecular formula of BAS 06741900 is C18H16N2O4S.
What is the molecular weight of BAS 06741900?
The molecular weight of BAS 06741900 is 356.08 g/mol.
Where can I buy BAS 06741900?
You can request a quote for BAS 06741900 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06741900?
Yes, KEHONG BIO provides custom synthesis services for BAS 06741900 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.