SB-406725A Free base
TL;DR: SB-406725A Free base (CAS 318528-48-2) is a chemical compound with molecular formula C21H22Cl2N2O3 and molecular weight 420.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetyl-N-(5,8-dichloro-1,2,3,4-tetrahydroisoquinolin-7-yl)-4-propan-2-yloxybenzamide
Also Known As: SB-406725A free base, 3-Acetyl-N-(5,8-dichloro-1,2,3,4-tetrahydro-7-isoquinolinyl)-4-(1-methylethoxy)benzamide, Benzamide, 3-acetyl-N-(5,8-dichloro-1,2,3,4-tetrahydro-7-isoquinolinyl)-4-(1-methylethoxy)-, 3-acetyl-N-(5,8-dichloro-1,2,3,4-tetrahydroisoquinolin-7-yl)-4-propan-2-yloxy-benzamide, RefChem:202948
| Molecular Formula | C21H22Cl2N2O3 |
|---|---|
| Molecular Weight | 420.10 g/mol |
| LogP | 4.8812 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 420.10074 |
| Heavy Atoms | 28 |
| Complexity | 941.73334 |
Chemical Identifiers
| CAS Number | 318528-48-2 |
|---|---|
| SMILES | CC(C)OC1=C(C=C(C=C1)C(=O)NC2=CC(=C3CCNCC3=C2Cl)Cl)C(=O)C |
Product Overview
SB-406725A Free base (CAS 318528-48-2), with molecular formula C21H22Cl2N2O3 and molecular weight 420.10 g/mol. IUPAC: 3-acetyl-N-(5,8-dichloro-1,2,3,4-tetrahydroisoquinolin-7-yl)-4-propan-2-yloxybenzamide.
Chemical Property Profile of SB-406725A Free base
Property Insights of SB-406725A Free base
The XLogP value of 4.8812 indicates that SB-406725A Free base is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for SB-406725A Free base. Following Lipinski's Rule of Five, SB-406725A Free base has 2 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 SB-406725A Free base?
The CAS number of SB-406725A Free base is 318528-48-2.
What is the molecular formula of SB-406725A Free base?
The molecular formula of SB-406725A Free base is C21H22Cl2N2O3.
What is the molecular weight of SB-406725A Free base?
The molecular weight of SB-406725A Free base is 420.10 g/mol.
Where can I buy SB-406725A Free base?
You can request a quote for SB-406725A Free base directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SB-406725A Free base?
Yes, KEHONG BIO provides custom synthesis services for SB-406725A Free base and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.