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Methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate
TL;DR: Methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate (CAS 328284-49-7) is a chemical compound with molecular formula C17H16N2O7 and molecular weight 360.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate
Also Known As: BIM-0030818.P001, methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate, methyl 3-((2,4-dimethoxyphenyl)carbamoyl)-5-nitrobenzoate, methyl 5-[N-(2,4-dimethoxyphenyl)carbamoyl]-3-nitrobenzoate, METHYL 3-[(2,4-DIMETHOXYANILINO)CARBONYL]-5-NITROBENZOATE
| Molecular Formula | C17H16N2O7 |
|---|---|
| Molecular Weight | 360.10 g/mol |
| LogP | 2.6509 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 360.09576 |
| Heavy Atoms | 26 |
| Complexity | 864.18506 |
Chemical Identifiers
| CAS Number | 328284-49-7 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC)OC |
Product Overview
Methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate (CAS 328284-49-7), with molecular formula C17H16N2O7 and molecular weight 360.10 g/mol. IUPAC: methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate.
Chemical Property Profile of Methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate
Property Insights of Methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate
The XLogP value of 2.6509 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate. Following Lipinski's Rule of Five, Methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate has 1 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 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate?
The CAS number of Methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate is 328284-49-7.
What is the molecular formula of Methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate?
The molecular formula of Methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate is C17H16N2O7.
What is the molecular weight of Methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate?
The molecular weight of Methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate is 360.10 g/mol.
Where can I buy Methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate?
You can request a quote for Methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-[(2,4-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.