3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide
TL;DR: 3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide (CAS 346715-52-4) is a chemical compound with molecular formula C23H16ClNO4 and molecular weight 405.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)prop-2-enamide
Also Known As: 3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide, (E)-3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)prop-2-enamide, (E)-3-(benzo[d][1,3]dioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide, (2E)-3-(1,3-benzodioxol-5-yl)-N-[4-chloro-2-(phenylcarbonyl)phenyl]prop-2-enamide, (2E)-3-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)-N-[4-chloro-2-(phenylcarbonyl)phenyl ]prop-2-enamide
| Molecular Formula | C23H16ClNO4 |
|---|---|
| Molecular Weight | 405.08 g/mol |
| LogP | 4.9516 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 405.07678 |
| Heavy Atoms | 29 |
| Complexity | 1109.1156 |
Chemical Identifiers
| CAS Number | 346715-52-4 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)/C=C/C(=O)NC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4 |
Product Overview
3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide (CAS 346715-52-4), with molecular formula C23H16ClNO4 and molecular weight 405.08 g/mol. IUPAC: (E)-3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)prop-2-enamide.
Chemical Property Profile of 3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide
Property Insights of 3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide
The XLogP value of 4.9516 indicates that 3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide. Following Lipinski's Rule of Five, 3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide 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 3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide?
The CAS number of 3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide is 346715-52-4.
What is the molecular formula of 3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide?
The molecular formula of 3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide is C23H16ClNO4.
What is the molecular weight of 3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide?
The molecular weight of 3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide is 405.08 g/mol.
Where can I buy 3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide?
You can request a quote for 3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,3-benzodioxol-5-yl)-N-(2-benzoyl-4-chlorophenyl)acrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.