RefChem:352560
TL;DR: RefChem:352560 (CAS 172985-23-8) is a chemical compound with molecular formula C22H23ClN2O3 and molecular weight 398.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-amino-12,12-dimethyl-8-propyl-5,11-dioxa-7-azatricyclo[7.4.0.02,6]trideca-1(9),2(6),3,7-tetraen-4-yl)-(4-chlorophenyl)methanone
Also Known As: Methanone, (1-amino-8,9-dihydro-8,8-dimethyl-5-propyl-6H-furo(2,3-b)pyrano(4,3-d)pyridin-2-yl)(4-chlorophenyl)-, (1-amino-8,8-dimethyl-5-propyl-8,9-dihydro-6H-furo[2,3-b]pyrano[4,3-d]pyridin-2-yl)(4-chlorophenyl)methanone, 1-amino-8,8-dimethyl-5-propyl(8,9-dihydro-6H-furano[2,3-b]pyrano[4,3-d]pyridin -2-yl) 4-chlorophenyl ketone, RefChem:352560
| Molecular Formula | C22H23ClN2O3 |
|---|---|
| Molecular Weight | 398.14 g/mol |
| LogP | 5.0982 |
| Topological Polar Surface Area | 78.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 398.1397 |
| Heavy Atoms | 28 |
| Complexity | 1067.8157 |
Chemical Identifiers
| CAS Number | 172985-23-8 |
|---|---|
| SMILES | CCCC1=NC2=C(C3=C1COC(C3)(C)C)C(=C(O2)C(=O)C4=CC=C(C=C4)Cl)N |
Product Overview
RefChem:352560 (CAS 172985-23-8), with molecular formula C22H23ClN2O3 and molecular weight 398.14 g/mol. IUPAC: (3-amino-12,12-dimethyl-8-propyl-5,11-dioxa-7-azatricyclo[7.4.0.02,6]trideca-1(9),2(6),3,7-tetraen-4-yl)-(4-chlorophenyl)methanone.
Chemical Property Profile of RefChem:352560
Property Insights of RefChem:352560
The XLogP value of 5.0982 indicates that RefChem:352560 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.35 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:352560. Following Lipinski's Rule of Five, RefChem:352560 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:352560?
The CAS number of RefChem:352560 is 172985-23-8.
What is the molecular formula of RefChem:352560?
The molecular formula of RefChem:352560 is C22H23ClN2O3.
What is the molecular weight of RefChem:352560?
The molecular weight of RefChem:352560 is 398.14 g/mol.
Where can I buy RefChem:352560?
You can request a quote for RefChem:352560 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:352560?
Yes, KEHONG BIO provides custom synthesis services for RefChem:352560 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.