3-(Dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate
TL;DR: 3-(Dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate (CAS 87626-60-6) is a chemical compound with molecular formula C22H23NO4 and molecular weight 365.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate
Also Known As: 3-(dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate, 3-Dimethylaminopropyl 2-(4-oxo-2-phenyl-chromen-8-yl)acetate, 3-(Dimethylamino)propyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate
| Molecular Formula | C22H23NO4 |
|---|---|
| Molecular Weight | 365.16 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 365.16272 |
| Heavy Atoms | 27 |
| Complexity | 551.0 |
Chemical Identifiers
| CAS Number | 87626-60-6 |
|---|---|
| SMILES | CN(C)CCCOC(=O)CC1=C2C(=CC=C1)C(=O)C=C(O2)C3=CC=CC=C3 |
| InChIKey | DVXVABXMIWZNKL-UHFFFAOYSA-N |
Product Overview
3-(Dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate (CAS 87626-60-6), with molecular formula C22H23NO4 and molecular weight 365.16 g/mol. IUPAC: 3-(dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate.
Chemical Property Profile of 3-(Dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate
Property Insights of 3-(Dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate
The XLogP value of 3.4 indicates that 3-(Dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, 3-(Dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate has 0 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 3-(Dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate?
The CAS number of 3-(Dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate is 87626-60-6.
What is the molecular formula of 3-(Dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate?
The molecular formula of 3-(Dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate is C22H23NO4.
What is the molecular weight of 3-(Dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate?
The molecular weight of 3-(Dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate is 365.16 g/mol.
Where can I buy 3-(Dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate?
You can request a quote for 3-(Dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for 3-(Dimethylamino)propyl 2-(4-oxo-2-phenylchromen-8-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.