BAS 00329314
TL;DR: BAS 00329314 (CAS 170658-13-6) is a chemical compound with molecular formula C19H18Cl2N2O and molecular weight 360.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-N-(2,4-dichlorophenyl)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)acetamide
Also Known As: BAS 00329314, N-(2,4-Dichlorophenyl)-2-(3,4-dihydro-3,3-dimethyl-1(2H)-isoquinolinylidene)acetamide, Acetamide, N-(2,4-dichlorophenyl)-2-(3,4-dihydro-3,3-dimethyl-1(2H)-isoquinolinylidene)-, (2E)-N-(2,4-dichlorophenyl)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)acetamide
| Molecular Formula | C19H18Cl2N2O |
|---|---|
| Molecular Weight | 360.08 g/mol |
| LogP | 4.8973 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 360.07962 |
| Heavy Atoms | 24 |
| Complexity | 827.8665 |
Chemical Identifiers
| CAS Number | 170658-13-6 |
|---|---|
| SMILES | CC1(CC2=CC=CC=C2/C(=C\C(=O)NC3=C(C=C(C=C3)Cl)Cl)/N1)C |
Product Overview
BAS 00329314 (CAS 170658-13-6), with molecular formula C19H18Cl2N2O and molecular weight 360.08 g/mol. IUPAC: (2E)-N-(2,4-dichlorophenyl)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)acetamide.
Chemical Property Profile of BAS 00329314
Property Insights of BAS 00329314
The XLogP value of 4.8973 indicates that BAS 00329314 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, BAS 00329314 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00329314 has 2 hydrogen bond donor(s) and 2 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 00329314?
The CAS number of BAS 00329314 is 170658-13-6.
What is the molecular formula of BAS 00329314?
The molecular formula of BAS 00329314 is C19H18Cl2N2O.
What is the molecular weight of BAS 00329314?
The molecular weight of BAS 00329314 is 360.08 g/mol.
Where can I buy BAS 00329314?
You can request a quote for BAS 00329314 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00329314?
Yes, KEHONG BIO provides custom synthesis services for BAS 00329314 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.