BIM-0027568.P001
TL;DR: BIM-0027568.P001 (CAS 5671-03-4) is a chemical compound with molecular formula C20H22Cl2N2O and molecular weight 376.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chlorophenyl)-2-(2,3,3-trimethyl-4H-isoquinolin-2-ium-1-yl)acetamide chloride
Also Known As: BIM-0027568.P001, 1-{2-[(2-chlorophenyl)amino]-2-oxoethyl}-2,3,3-trimethyl-3,4-dihydroisoquinolinium chloride, N-(2-chlorophenyl)-2-(2,3,3-trimethyl-4H-isoquinolin-2-ium-1-yl)acetamide;chloride, N-(2-chlorophenyl)-2-(2,3,3-trimethyl-4H-isoquinolin-2-ium-1-yl)acetamide chloride
| Molecular Formula | C20H22Cl2N2O |
|---|---|
| Molecular Weight | 376.11 g/mol |
| LogP | 1.1389 |
| Topological Polar Surface Area | 32.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 376.11093 |
| Heavy Atoms | 25 |
| Complexity | 827.9508 |
Chemical Identifiers
| CAS Number | 5671-03-4 |
|---|---|
| SMILES | CC1(CC2=CC=CC=C2C(=[N+]1C)CC(=O)NC3=CC=CC=C3Cl)C.[Cl-] |
Product Overview
BIM-0027568.P001 (CAS 5671-03-4), with molecular formula C20H22Cl2N2O and molecular weight 376.11 g/mol. IUPAC: N-(2-chlorophenyl)-2-(2,3,3-trimethyl-4H-isoquinolin-2-ium-1-yl)acetamide chloride.
Chemical Property Profile of BIM-0027568.P001
Property Insights of BIM-0027568.P001
The XLogP value of 1.1389 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0027568.P001. With a topological polar surface area (TPSA) of 32.11 Ų, BIM-0027568.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0027568.P001 has 1 hydrogen bond donor(s) and 1 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 BIM-0027568.P001?
The CAS number of BIM-0027568.P001 is 5671-03-4.
What is the molecular formula of BIM-0027568.P001?
The molecular formula of BIM-0027568.P001 is C20H22Cl2N2O.
What is the molecular weight of BIM-0027568.P001?
The molecular weight of BIM-0027568.P001 is 376.11 g/mol.
Where can I buy BIM-0027568.P001?
You can request a quote for BIM-0027568.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0027568.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0027568.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.