RefChem:1089949
TL;DR: RefChem:1089949 (CAS 132680-96-7) is a chemical compound with molecular formula C19H27ClN2O4 and molecular weight 382.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-(6,7-dimethoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-1-morpholin-4-ylethanone;hydrochloride
Also Known As: Morpholine, 4-((3,4-dihydro-6,7-dimethoxy-3,3-dimethyl-1(2H)-isoquinolinylidene)acetyl)-, monohydrochloride, (Z), (2Z)-2-(6,7-dimethoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-1-morpholin-4-ylethanone hydrochloride, RefChem:1089949
| Molecular Formula | C19H27ClN2O4 |
|---|---|
| Molecular Weight | 382.17 g/mol |
| LogP | 2.2496 |
| Topological Polar Surface Area | 60.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 382.16592 |
| Heavy Atoms | 26 |
| Complexity | 697.0247 |
Chemical Identifiers
| CAS Number | 132680-96-7 |
|---|---|
| SMILES | CC1(CC2=CC(=C(C=C2/C(=C/C(=O)N3CCOCC3)/N1)OC)OC)C.Cl |
Product Overview
RefChem:1089949 (CAS 132680-96-7), with molecular formula C19H27ClN2O4 and molecular weight 382.17 g/mol. IUPAC: (2Z)-2-(6,7-dimethoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-1-morpholin-4-ylethanone;hydrochloride.
Chemical Property Profile of RefChem:1089949
Property Insights of RefChem:1089949
The XLogP value of 2.2496 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1089949. The TPSA of 60.03 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1089949. Following Lipinski's Rule of Five, RefChem:1089949 has 1 hydrogen bond donor(s) and 5 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 RefChem:1089949?
The CAS number of RefChem:1089949 is 132680-96-7.
What is the molecular formula of RefChem:1089949?
The molecular formula of RefChem:1089949 is C19H27ClN2O4.
What is the molecular weight of RefChem:1089949?
The molecular weight of RefChem:1089949 is 382.17 g/mol.
Where can I buy RefChem:1089949?
You can request a quote for RefChem:1089949 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1089949?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1089949 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.