Methyl 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate
TL;DR: Methyl 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate (CAS 708248-98-0) is a chemical compound with molecular formula C20H21N3O5 and molecular weight 383.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[4-(morpholine-4-carbonyl)phenyl]carbamoylamino]benzoate
Also Known As: methyl 2-(3-(4-(morpholine-4-carbonyl)phenyl)ureido)benzoate, methyl 2-[[4-(morpholine-4-carbonyl)phenyl]carbamoylamino]benzoate, methyl 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate
| Molecular Formula | C20H21N3O5 |
|---|---|
| Molecular Weight | 383.15 g/mol |
| LogP | 2.5896 |
| Topological Polar Surface Area | 96.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.14813 |
| Heavy Atoms | 28 |
| Complexity | 860.3998 |
Chemical Identifiers
| CAS Number | 708248-98-0 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)C(=O)N3CCOCC3 |
Product Overview
Methyl 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate (CAS 708248-98-0), with molecular formula C20H21N3O5 and molecular weight 383.15 g/mol. IUPAC: methyl 2-[[4-(morpholine-4-carbonyl)phenyl]carbamoylamino]benzoate.
Chemical Property Profile of Methyl 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate
Property Insights of Methyl 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate
The XLogP value of 2.5896 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate. The TPSA of 96.97 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate. Following Lipinski's Rule of Five, Methyl 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate has 2 hydrogen bond donor(s) and 5 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 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate?
The CAS number of Methyl 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate is 708248-98-0.
What is the molecular formula of Methyl 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate?
The molecular formula of Methyl 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate is C20H21N3O5.
What is the molecular weight of Methyl 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate?
The molecular weight of Methyl 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate is 383.15 g/mol.
Where can I buy Methyl 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate?
You can request a quote for Methyl 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}carbonylamino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.