(Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide
TL;DR: (Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide (CAS 370854-68-5) is a chemical compound with molecular formula C21H22N2O5 and molecular weight 382.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-6-tert-butyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Also Known As: (Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide, N'-[(Z)-1,3-benzodioxol-5-ylmethylidene]-7-tert-butyl-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide, N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-6-tert-butyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide
| Molecular Formula | C21H22N2O5 |
|---|---|
| Molecular Weight | 382.15 g/mol |
| LogP | 3.0029 |
| Topological Polar Surface Area | 78.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 382.15286 |
| Heavy Atoms | 28 |
| Complexity | 932.87854 |
Chemical Identifiers
| CAS Number | 370854-68-5 |
|---|---|
| SMILES | CC(C)(C)C1=CC2=C(C=C1)OCC(O2)C(=O)N/N=C\C3=CC4=C(C=C3)OCO4 |
Product Overview
(Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide (CAS 370854-68-5), with molecular formula C21H22N2O5 and molecular weight 382.15 g/mol. IUPAC: N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-6-tert-butyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide.
Chemical Property Profile of (Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide
Property Insights of (Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide
The XLogP value of 3.0029 indicates that (Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.38 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide. Following Lipinski's Rule of Five, (Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide has 1 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 (Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
The CAS number of (Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide is 370854-68-5.
What is the molecular formula of (Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
The molecular formula of (Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide is C21H22N2O5.
What is the molecular weight of (Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
The molecular weight of (Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide is 382.15 g/mol.
Where can I buy (Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
You can request a quote for (Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-N'-(benzo[d][1,3]dioxol-5-ylmethylene)-7-(tert-butyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.