BAS 03058698
TL;DR: BAS 03058698 (CAS 428494-05-7) is a chemical compound with molecular formula C24H23FN2O3S and molecular weight 438.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(4-fluorophenyl)-4-methylbenzenesulfonamide
Also Known As: BAS 03058698, AH-487/15582312, N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(4-fluorophenyl)-4-methylbenzenesulfonamide, N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-(4-fluorophenyl)-4-methylbenzenesulfonamide, N-(4-FLUOROPHENYL)-4-METHYL-N-[2-OXO-2-(1,2,3,4-TETRAHYDROISOQUINOLIN-2-YL)ETHYL]BENZENE-1-SULFONAMIDE
| Molecular Formula | C24H23FN2O3S |
|---|---|
| Molecular Weight | 438.14 g/mol |
| LogP | 3.91432 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 438.14133 |
| Heavy Atoms | 31 |
| Complexity | 1192.2539 |
Chemical Identifiers
| CAS Number | 428494-05-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CCC3=CC=CC=C3C2)C4=CC=C(C=C4)F |
Product Overview
BAS 03058698 (CAS 428494-05-7), with molecular formula C24H23FN2O3S and molecular weight 438.14 g/mol. IUPAC: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(4-fluorophenyl)-4-methylbenzenesulfonamide.
Chemical Property Profile of BAS 03058698
Property Insights of BAS 03058698
The XLogP value of 3.91432 indicates that BAS 03058698 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.69 Ų, BAS 03058698 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 03058698 has 0 hydrogen bond donor(s) and 3 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 03058698?
The CAS number of BAS 03058698 is 428494-05-7.
What is the molecular formula of BAS 03058698?
The molecular formula of BAS 03058698 is C24H23FN2O3S.
What is the molecular weight of BAS 03058698?
The molecular weight of BAS 03058698 is 438.14 g/mol.
Where can I buy BAS 03058698?
You can request a quote for BAS 03058698 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03058698?
Yes, KEHONG BIO provides custom synthesis services for BAS 03058698 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.