(E)-3-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth
TL;DR: (E)-3-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth (CAS 30866-38-7) is a chemical compound with molecular formula C19H13N3O5 and molecular weight 363.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzodioxol-5-yl)-N-(1,3-benzodioxol-5-ylmethylideneamino)-2-cyanoprop-2-enamide
Also Known As: (E)-3-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth, 3-(1,3-benzodioxol-5-yl)-N-(1,3-benzodioxol-5-ylmethylideneamino)-2-cyanoprop-2-enamide
| Molecular Formula | C19H13N3O5 |
|---|---|
| Molecular Weight | 363.09 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 363.0855 |
| Heavy Atoms | 27 |
| Complexity | 670.0 |
Chemical Identifiers
| CAS Number | 30866-38-7 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C=C(C#N)C(=O)NN=CC3=CC4=C(C=C3)OCO4 |
| InChIKey | DDEFTXALEYSJIW-UHFFFAOYSA-N |
Product Overview
(E)-3-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth (CAS 30866-38-7), with molecular formula C19H13N3O5 and molecular weight 363.09 g/mol. IUPAC: 3-(1,3-benzodioxol-5-yl)-N-(1,3-benzodioxol-5-ylmethylideneamino)-2-cyanoprop-2-enamide.
Chemical Property Profile of (E)-3-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth
Property Insights of (E)-3-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth. Following Lipinski's Rule of Five, (E)-3-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth has 1 hydrogen bond donor(s) and 7 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-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth?
The CAS number of (E)-3-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth is 30866-38-7.
What is the molecular formula of (E)-3-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth?
The molecular formula of (E)-3-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth is C19H13N3O5.
What is the molecular weight of (E)-3-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth?
The molecular weight of (E)-3-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth is 363.09 g/mol.
Where can I buy (E)-3-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth?
You can request a quote for (E)-3-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(1,3-benzodioxol-5-yl)-N-[(E)-1,3-benzodioxol-5-ylmeth and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.