![(E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide structure](/static/products/400/400833-33-2.png)
(E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide
TL;DR: (E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide (CAS 400833-33-2) is a chemical compound with molecular formula C21H15BrN4O3S and molecular weight 482.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide
Also Known As: (E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide, N'-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylidene]-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide, N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-3-methyl-1-phenylthieno[2,3-c]pyrazole-5-carboxamide
| Molecular Formula | C21H15BrN4O3S |
|---|---|
| Molecular Weight | 482.00 g/mol |
| LogP | 4.65052 |
| Topological Polar Surface Area | 77.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 482.00482 |
| Heavy Atoms | 30 |
| Complexity | 1296.8252 |
Chemical Identifiers
| CAS Number | 400833-33-2 |
|---|---|
| SMILES | CC1=NN(C2=C1C=C(S2)C(=O)N/N=C/C3=CC4=C(C=C3Br)OCO4)C5=CC=CC=C5 |
Product Overview
(E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide (CAS 400833-33-2), with molecular formula C21H15BrN4O3S and molecular weight 482.00 g/mol. IUPAC: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide.
Chemical Property Profile of (E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide
Property Insights of (E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide
The XLogP value of 4.65052 indicates that (E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.74 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide. Following Lipinski's Rule of Five, (E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-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 (E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide?
The CAS number of (E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide is 400833-33-2.
What is the molecular formula of (E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide?
The molecular formula of (E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide is C21H15BrN4O3S.
What is the molecular weight of (E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide?
The molecular weight of (E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide is 482.00 g/mol.
Where can I buy (E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide?
You can request a quote for (E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]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'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N'-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.