![Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate structure](/static/products/7067/706772-93-2.webp)
Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate
TL;DR: Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate (CAS 706772-93-2) is a chemical compound with molecular formula C17H17N3O7 and molecular weight 375.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4,5-dimethoxy-2-[(4-nitrophenyl)carbamoylamino]benzoate
Also Known As: methyl 4,5-dimethoxy-2-(3-(4-nitrophenyl)ureido)benzoate, methyl 4,5-dimethoxy-2-[(4-nitrophenyl)carbamoylamino]benzoate, methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate, METHYL 4,5-DIMETHOXY-2-{[(4-NITROANILINO)CARBONYL]AMINO}BENZOATE, methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)amino]carbonylamino}benzoate
| Molecular Formula | C17H17N3O7 |
|---|---|
| Molecular Weight | 375.11 g/mol |
| LogP | 3.0426 |
| Topological Polar Surface Area | 129.03 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 375.10666 |
| Heavy Atoms | 27 |
| Complexity | 865.5759 |
Chemical Identifiers
| CAS Number | 706772-93-2 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])OC |
Product Overview
Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate (CAS 706772-93-2), with molecular formula C17H17N3O7 and molecular weight 375.11 g/mol. IUPAC: methyl 4,5-dimethoxy-2-[(4-nitrophenyl)carbamoylamino]benzoate.
Chemical Property Profile of Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate
Property Insights of Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate
The XLogP value of 3.0426 indicates that Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 129.03 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate. Following Lipinski's Rule of Five, Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate has 2 hydrogen bond donor(s) and 7 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 Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate?
The CAS number of Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate is 706772-93-2.
What is the molecular formula of Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate?
The molecular formula of Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate is C17H17N3O7.
What is the molecular weight of Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate?
The molecular weight of Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate is 375.11 g/mol.
Where can I buy Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate?
You can request a quote for Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4,5-dimethoxy-2-{[(4-nitrophenyl)carbamoyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.