![N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide structure](/static/products/102/1025099-87-9.png)
N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide
TL;DR: N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide (CAS 1025099-87-9) is a chemical compound with molecular formula C27H25N5O5S and molecular weight 531.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzamido-N-[1-[2-[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl]-1-oxobutan-2-yl]benzamide
Also Known As: N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide, 2-benzamido-N-[1-[[(2-benzooxazol-2-ylsulfanylacetyl)amino]carbamoyl]propyl]benzamide, 2-benzamido-N-(1-(2-(2-(benzo[d]oxazol-2-ylthio)acetyl)hydrazinyl)-1-oxobutan-2-yl)benzamide, 2-benzamido-N-[1-[2-[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl]-1-oxobutan-2-yl]benzamide, N-(1-{N'-[2-(Benzooxazol-2-ylsulfanyl)-acetyl]-hydrazinocarbonyl}-propyl)-2-benzoylamino-benzamide
| Molecular Formula | C27H25N5O5S |
|---|---|
| Molecular Weight | 531.16 g/mol |
| LogP | 3.5282 |
| Topological Polar Surface Area | 142.43 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 531.15765 |
| Heavy Atoms | 38 |
| Complexity | 1423.5427 |
Chemical Identifiers
| CAS Number | 1025099-87-9 |
|---|---|
| SMILES | CCC(C(=O)NNC(=O)CSC1=NC2=CC=CC=C2O1)NC(=O)C3=CC=CC=C3NC(=O)C4=CC=CC=C4 |
Product Overview
N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide (CAS 1025099-87-9), with molecular formula C27H25N5O5S and molecular weight 531.16 g/mol. IUPAC: 2-benzamido-N-[1-[2-[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl]-1-oxobutan-2-yl]benzamide.
Chemical Property Profile of N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide
Property Insights of N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide
The XLogP value of 3.5282 indicates that N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 142.43 Ų indicates high polarity, suggesting N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide has 4 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 N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide?
The CAS number of N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide is 1025099-87-9.
What is the molecular formula of N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide?
The molecular formula of N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide is C27H25N5O5S.
What is the molecular weight of N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide?
The molecular weight of N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide is 531.16 g/mol.
Where can I buy N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide?
You can request a quote for N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1-{2-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinyl}-1-oxobutan-2-yl)-2-[(phenylcarbonyl)amino]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.