(E)-N-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide
TL;DR: (E)-N-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide (CAS 385387-77-9) is a chemical compound with molecular formula C24H18N6O9 and molecular weight 534.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[N'-(1,3-benzoxazol-2-yl)-N-[2-(2-nitrophenoxy)acetyl]carbamimidoyl]-2-(2-nitrophenoxy)acetamide
Also Known As: (E)-N-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide, N-(1,3-BENZOXAZOL-2-YL)-N',N''-BIS[2-(2-NITROPHENOXY)ACETYL]GUANIDINE, N-[(1E)-1-(benzoxazol-2-ylamino)-4-(2-nitrophenoxy)-3-oxo-2-azabut-1-enyl]-2-( 2-nitrophenoxy)acetamide, N-[(Z)-(1,3-benzoxazol-2-ylamino){[(2-nitrophenoxy)acetyl]amino}methylidene]-2-(2-nitrophenoxy)acetamide, N-[N'-(1,3-benzoxazol-2-yl)-N-[2-(2-nitrophenoxy)acetyl]carbamimidoyl]-2-(2-nitrophenoxy)acetamide
| Molecular Formula | C24H18N6O9 |
|---|---|
| Molecular Weight | 534.11 g/mol |
| LogP | 3.0221 |
| Topological Polar Surface Area | 201.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 534.1135 |
| Heavy Atoms | 39 |
| Complexity | 1472.6254 |
Chemical Identifiers
| CAS Number | 385387-77-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(O2)N=C(NC(=O)COC3=CC=CC=C3[N+](=O)[O-])NC(=O)COC4=CC=CC=C4[N+](=O)[O-] |
Product Overview
(E)-N-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide (CAS 385387-77-9), with molecular formula C24H18N6O9 and molecular weight 534.11 g/mol. IUPAC: N-[N'-(1,3-benzoxazol-2-yl)-N-[2-(2-nitrophenoxy)acetyl]carbamimidoyl]-2-(2-nitrophenoxy)acetamide.
Chemical Property Profile of (E)-N-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide
Property Insights of (E)-N-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide
The XLogP value of 3.0221 indicates that (E)-N-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 201.33 Ų indicates high polarity, suggesting (E)-N-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (E)-N-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide has 2 hydrogen bond donor(s) and 11 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-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide?
The CAS number of (E)-N-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide is 385387-77-9.
What is the molecular formula of (E)-N-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide?
The molecular formula of (E)-N-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide is C24H18N6O9.
What is the molecular weight of (E)-N-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide?
The molecular weight of (E)-N-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide is 534.11 g/mol.
Where can I buy (E)-N-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide?
You can request a quote for (E)-N-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(N-(benzo[d]oxazol-2-yl)-N'-(2-(2-nitrophenoxy)acetyl)carbamimidoyl)-2-(2-nitrophenoxy)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.