C21H24ClN3O
TL;DR: C21H24ClN3O (CAS 244608-64-8) is a chemical compound with molecular formula C21H24ClN3O and molecular weight 369.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]amino]-3,3-dimethyl-4H-isoquinolin-1-amine;hydrochloride
Also Known As: (Z)-1-((E)-((E)-3-(4-methoxyphenyl)allylidene)hydrazono)-3,3-dimethyl-1,2,3,4-tetrahydroisoquinoline hydrochloride
| Molecular Formula | C21H24ClN3O |
|---|---|
| Molecular Weight | 369.16 g/mol |
| LogP | 4.4871 |
| Topological Polar Surface Area | 45.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 369.1608 |
| Heavy Atoms | 26 |
| Complexity | 823.4048 |
Chemical Identifiers
| CAS Number | 244608-64-8 |
|---|---|
| SMILES | CC1(CC2=CC=CC=C2C(=N1)N/N=C/C=C/C3=CC=C(C=C3)OC)C.Cl |
Product Overview
C21H24ClN3O (CAS 244608-64-8), with molecular formula C21H24ClN3O and molecular weight 369.16 g/mol. IUPAC: N-[(E)-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]amino]-3,3-dimethyl-4H-isoquinolin-1-amine;hydrochloride.
Chemical Property Profile of C21H24ClN3O
Property Insights of C21H24ClN3O
The XLogP value of 4.4871 indicates that C21H24ClN3O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.98 Ų, C21H24ClN3O exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C21H24ClN3O has 1 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 C21H24ClN3O?
The CAS number of C21H24ClN3O is 244608-64-8.
What is the molecular formula of C21H24ClN3O?
The molecular formula of C21H24ClN3O is C21H24ClN3O.
What is the molecular weight of C21H24ClN3O?
The molecular weight of C21H24ClN3O is 369.16 g/mol.
Where can I buy C21H24ClN3O?
You can request a quote for C21H24ClN3O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C21H24ClN3O?
Yes, KEHONG BIO provides custom synthesis services for C21H24ClN3O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.