![(E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide structure](/static/products/423/423154-13-6.png)
(E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide
TL;DR: (E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide (CAS 423154-13-6) is a chemical compound with molecular formula C16H16N4O3 and molecular weight 312.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[(E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-ylidene]amino]-5-methyl-1H-pyrazole-3-carboxamide
Also Known As: (E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide, N'-[(2E,3E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-ylidene]-3-methyl-1H-pyrazole-5-carbohydrazide, N'-[3-(1,3-benzodioxol-5-yl)-1-methyl-2-propen-1-ylidene]-3-methyl-1H-pyrazole-5-carbohydrazide, N-[(E)-[(E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-ylidene]amino]-5-methyl-1H-pyrazole-3-carboxamide
| Molecular Formula | C16H16N4O3 |
|---|---|
| Molecular Weight | 312.12 g/mol |
| LogP | 2.26592 |
| Topological Polar Surface Area | 88.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.12225 |
| Heavy Atoms | 23 |
| Complexity | 792.3731 |
Chemical Identifiers
| CAS Number | 423154-13-6 |
|---|---|
| SMILES | CC1=CC(=NN1)C(=O)N/N=C(\C)/C=C/C2=CC3=C(C=C2)OCO3 |
Product Overview
(E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide (CAS 423154-13-6), with molecular formula C16H16N4O3 and molecular weight 312.12 g/mol. IUPAC: N-[(E)-[(E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-ylidene]amino]-5-methyl-1H-pyrazole-3-carboxamide.
Chemical Property Profile of (E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide
Property Insights of (E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide
The XLogP value of 2.26592 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide. The TPSA of 88.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide. Following Lipinski's Rule of Five, (E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide has 2 hydrogen bond donor(s) and 5 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)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide?
The CAS number of (E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide is 423154-13-6.
What is the molecular formula of (E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide?
The molecular formula of (E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide is C16H16N4O3.
What is the molecular weight of (E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide?
The molecular weight of (E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide is 312.12 g/mol.
Where can I buy (E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide?
You can request a quote for (E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N'-((E)-4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-ylidene)-3-methyl-1H-pyrazole-5-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.