![(E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide structure](/static/products/325/325831-51-4.png)
(E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide
TL;DR: (E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide (CAS 325831-51-4) is a chemical compound with molecular formula C24H24BrN5O3S and molecular weight 541.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-(azepan-1-ylmethyl)-5-bromo-2-hydroxyindol-3-yl]imino-2-(1,3-benzoxazol-2-ylsulfanyl)acetamide
Also Known As: (E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide, N'-[(3E)-1-(azepan-1-ylmethyl)-5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2-(1,3-benzoxazol-2-ylsulfanyl)acetohydrazide, N-[(E)-[1-(azepan-1-ylmethyl)-5-bromo-2-oxoindol-3-ylidene]amino]-2-(1,3-benzoxazol-2-ylsulfanyl)acetamide, N-[(Z)-[1-(azepan-1-ylmethyl)-5-bromo-2-oxoindol-3-ylidene]amino]-2-(1,3-benzoxazol-2-ylsulfanyl)acetamide, N-[[1-(azepan-1-ylmethyl)-5-bromo-2-oxoindol-3-ylidene]amino]-2-(1,3-benzoxazol-2-ylsulfanyl)acetamide
| Molecular Formula | C24H24BrN5O3S |
|---|---|
| Molecular Weight | 541.08 g/mol |
| LogP | 6.4867 |
| Topological Polar Surface Area | 96.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 541.0783 |
| Heavy Atoms | 34 |
| Complexity | 1324.6593 |
Chemical Identifiers
| CAS Number | 325831-51-4 |
|---|---|
| SMILES | C1CCCN(CC1)CN2C3=C(C=C(C=C3)Br)C(=C2O)N=NC(=O)CSC4=NC5=CC=CC=C5O4 |
Product Overview
(E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide (CAS 325831-51-4), with molecular formula C24H24BrN5O3S and molecular weight 541.08 g/mol. IUPAC: N-[1-(azepan-1-ylmethyl)-5-bromo-2-hydroxyindol-3-yl]imino-2-(1,3-benzoxazol-2-ylsulfanyl)acetamide.
Chemical Property Profile of (E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide
Property Insights of (E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide
The XLogP value of 6.4867 indicates that (E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.22 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide. Following Lipinski's Rule of Five, (E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide?
The CAS number of (E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide is 325831-51-4.
What is the molecular formula of (E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide?
The molecular formula of (E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide is C24H24BrN5O3S.
What is the molecular weight of (E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide?
The molecular weight of (E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide is 541.08 g/mol.
Where can I buy (E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide?
You can request a quote for (E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N'-(1-(azepan-1-ylmethyl)-5-bromo-2-oxoindolin-3-ylidene)-2-(benzo[d]oxazol-2-ylthio)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.