![(6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one structure](/static/products/383/383374-96-7.png)
(6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one
TL;DR: (6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one (CAS 383374-96-7) is a chemical compound with molecular formula C20H20N2O5 and molecular weight 368.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1H-pyrazol-3-yl]-5-methoxyphenol
Also Known As: (6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one, 2-(4-((3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)oxy)-5-methyl-1H-pyrazol-3-yl)-5-methoxyphenol, 2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-3-methyl-1H-pyrazol-5-yl]-5-methoxy-phenol, 2-[4-(3,4-DIHYDRO-2H-1,5-BENZODIOXEPIN-7-YLOXY)-5-METHYL-1H-PYRAZOL-3-YL]-5-METHOXYPHENOL, 6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one
| Molecular Formula | C20H20N2O5 |
|---|---|
| Molecular Weight | 368.14 g/mol |
| LogP | 4.05292 |
| Topological Polar Surface Area | 85.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 368.1372 |
| Heavy Atoms | 27 |
| Complexity | 967.0011 |
Chemical Identifiers
| CAS Number | 383374-96-7 |
|---|---|
| SMILES | CC1=C(C(=NN1)C2=C(C=C(C=C2)OC)O)OC3=CC4=C(C=C3)OCCCO4 |
Product Overview
(6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one (CAS 383374-96-7), with molecular formula C20H20N2O5 and molecular weight 368.14 g/mol. IUPAC: 2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1H-pyrazol-3-yl]-5-methoxyphenol.
Chemical Property Profile of (6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one
Property Insights of (6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one
The XLogP value of 4.05292 indicates that (6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.83 Ų falls within the moderate polarity range, balancing permeability and solubility for (6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one. Following Lipinski's Rule of Five, (6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one has 2 hydrogen bond donor(s) and 6 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 (6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one?
The CAS number of (6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one is 383374-96-7.
What is the molecular formula of (6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one?
The molecular formula of (6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one is C20H20N2O5.
What is the molecular weight of (6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one?
The molecular weight of (6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one is 368.14 g/mol.
Where can I buy (6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one?
You can request a quote for (6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one?
Yes, KEHONG BIO provides custom synthesis services for (6E)-6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yloxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.