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Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate
TL;DR: Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate (CAS 732995-60-7) is a chemical compound with molecular formula C16H15FN2O3 and molecular weight 302.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(4-fluorophenyl)carbamoylamino]-4-methylbenzoate
Also Known As: methyl 3-(3-(4-fluorophenyl)ureido)-4-methylbenzoate, methyl 3-[(4-fluorophenyl)carbamoylamino]-4-methylbenzoate, methyl 3-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate, methyl 3-{[(4-fluorophenyl)amino]carbonylamino}-4-methylbenzoate, METHYL 3-{[(4-FLUOROANILINO)CARBONYL]AMINO}-4-METHYLBENZOATE
| Molecular Formula | C16H15FN2O3 |
|---|---|
| Molecular Weight | 302.11 g/mol |
| LogP | 3.56472 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.10666 |
| Heavy Atoms | 22 |
| Complexity | 699.0372 |
Chemical Identifiers
| CAS Number | 732995-60-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)OC)NC(=O)NC2=CC=C(C=C2)F |
Product Overview
Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate (CAS 732995-60-7), with molecular formula C16H15FN2O3 and molecular weight 302.11 g/mol. IUPAC: methyl 3-[(4-fluorophenyl)carbamoylamino]-4-methylbenzoate.
Chemical Property Profile of Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate
Property Insights of Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate
The XLogP value of 3.56472 indicates that Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate. Following Lipinski's Rule of Five, Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate has 2 hydrogen bond donor(s) and 3 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-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate?
The CAS number of Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate is 732995-60-7.
What is the molecular formula of Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate?
The molecular formula of Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate is C16H15FN2O3.
What is the molecular weight of Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate?
The molecular weight of Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate is 302.11 g/mol.
Where can I buy Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate?
You can request a quote for Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}-4-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.