Methyl 3-(4-isopropylbenzamido)-4-morpholinobenzoate
TL;DR: Methyl 3-(4-isopropylbenzamido)-4-morpholinobenzoate (CAS 895094-98-1) is a chemical compound with molecular formula C22H26N2O4 and molecular weight 382.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-morpholin-4-yl-3-[(4-propan-2-ylbenzoyl)amino]benzoate
Also Known As: methyl 3-(4-isopropylbenzamido)-4-morpholinobenzoate, methyl 4-morpholin-4-yl-3-[(4-propan-2-ylbenzoyl)amino]benzoate, methyl 4-(morpholin-4-yl)-3-({[4-(propan-2-yl)phenyl]carbonyl}amino)benzoate
| Molecular Formula | C22H26N2O4 |
|---|---|
| Molecular Weight | 382.19 g/mol |
| LogP | 3.6855 |
| Topological Polar Surface Area | 67.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.18927 |
| Heavy Atoms | 28 |
| Complexity | 840.1153 |
Chemical Identifiers
| CAS Number | 895094-98-1 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCOCC3 |
Product Overview
Methyl 3-(4-isopropylbenzamido)-4-morpholinobenzoate (CAS 895094-98-1), with molecular formula C22H26N2O4 and molecular weight 382.19 g/mol. IUPAC: methyl 4-morpholin-4-yl-3-[(4-propan-2-ylbenzoyl)amino]benzoate.
Chemical Property Profile of Methyl 3-(4-isopropylbenzamido)-4-morpholinobenzoate
Property Insights of Methyl 3-(4-isopropylbenzamido)-4-morpholinobenzoate
The XLogP value of 3.6855 indicates that Methyl 3-(4-isopropylbenzamido)-4-morpholinobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.87 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-(4-isopropylbenzamido)-4-morpholinobenzoate. Following Lipinski's Rule of Five, Methyl 3-(4-isopropylbenzamido)-4-morpholinobenzoate has 1 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 3-(4-isopropylbenzamido)-4-morpholinobenzoate?
The CAS number of Methyl 3-(4-isopropylbenzamido)-4-morpholinobenzoate is 895094-98-1.
What is the molecular formula of Methyl 3-(4-isopropylbenzamido)-4-morpholinobenzoate?
The molecular formula of Methyl 3-(4-isopropylbenzamido)-4-morpholinobenzoate is C22H26N2O4.
What is the molecular weight of Methyl 3-(4-isopropylbenzamido)-4-morpholinobenzoate?
The molecular weight of Methyl 3-(4-isopropylbenzamido)-4-morpholinobenzoate is 382.19 g/mol.
Where can I buy Methyl 3-(4-isopropylbenzamido)-4-morpholinobenzoate?
You can request a quote for Methyl 3-(4-isopropylbenzamido)-4-morpholinobenzoate 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-isopropylbenzamido)-4-morpholinobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(4-isopropylbenzamido)-4-morpholinobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.