BAS 00690555
TL;DR: BAS 00690555 (CAS 1212338-82-3) is a chemical compound with molecular formula C26H27NO3 and molecular weight 401.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-2,2-diphenylethanone
Also Known As: BAS 00690555, (S)-1-(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)-2,2-diphenylethanone, 1-[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-2,2-diphenylethanone
| Molecular Formula | C26H27NO3 |
|---|---|
| Molecular Weight | 401.20 g/mol |
| LogP | 4.9816 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.1991 |
| Heavy Atoms | 30 |
| Complexity | 977.7085 |
Chemical Identifiers
| CAS Number | 1212338-82-3 |
|---|---|
| SMILES | C[C@H]1C2=CC(=C(C=C2CCN1C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)OC)OC |
Product Overview
BAS 00690555 (CAS 1212338-82-3), with molecular formula C26H27NO3 and molecular weight 401.20 g/mol. IUPAC: 1-[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-2,2-diphenylethanone.
Chemical Property Profile of BAS 00690555
Property Insights of BAS 00690555
The XLogP value of 4.9816 indicates that BAS 00690555 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.77 Ų, BAS 00690555 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00690555 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 00690555?
The CAS number of BAS 00690555 is 1212338-82-3.
What is the molecular formula of BAS 00690555?
The molecular formula of BAS 00690555 is C26H27NO3.
What is the molecular weight of BAS 00690555?
The molecular weight of BAS 00690555 is 401.20 g/mol.
Where can I buy BAS 00690555?
You can request a quote for BAS 00690555 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00690555?
Yes, KEHONG BIO provides custom synthesis services for BAS 00690555 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.