(E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one
TL;DR: (E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one (CAS 1062580-34-0) is a chemical compound with molecular formula C20H17NO3 and molecular weight 319.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]chromen-2-one
Also Known As: (E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one, 3-[(2E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]-2H-chromen-2-one, J2.946.949K, 3-[4-(Dimethylamino)-trans-cinnamoyl]coumarin, AB00672696-01
| Molecular Formula | C20H17NO3 |
|---|---|
| Molecular Weight | 319.12 g/mol |
| LogP | 3.7551 |
| Topological Polar Surface Area | 50.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.12085 |
| Heavy Atoms | 24 |
| Complexity | 966.0906 |
Chemical Identifiers
| CAS Number | 1062580-34-0 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)/C=C/C(=O)C2=CC3=CC=CC=C3OC2=O |
Product Overview
(E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one (CAS 1062580-34-0), with molecular formula C20H17NO3 and molecular weight 319.12 g/mol. IUPAC: 3-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]chromen-2-one.
Chemical Property Profile of (E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one
Property Insights of (E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one
The XLogP value of 3.7551 indicates that (E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.52 Ų, (E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one has 0 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 (E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one?
The CAS number of (E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one is 1062580-34-0.
What is the molecular formula of (E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one?
The molecular formula of (E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one is C20H17NO3.
What is the molecular weight of (E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one?
The molecular weight of (E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one is 319.12 g/mol.
Where can I buy (E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one?
You can request a quote for (E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(3-(4-(dimethylamino)phenyl)acryloyl)-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.