![Methyl 2-(4-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate structure](/static/products/7665/766527-36-0.webp)
Methyl 2-(4-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate
TL;DR: Methyl 2-(4-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate (CAS 766527-36-0) is a chemical compound with molecular formula C17H20N2O3S and molecular weight 332.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-morpholin-4-yl-5-(thiophen-2-ylmethylamino)benzoate
Also Known As: BAS 12414524, methyl 2-(4-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate, AN-465/43336734, methyl 2-morpholin-4-yl-5-(thiophen-2-ylmethylamino)benzoate, 2-Morpholin-4-yl-5-[(thiophen-2-ylmethyl)-amino]-benzoic acid methyl ester
| Molecular Formula | C17H20N2O3S |
|---|---|
| Molecular Weight | 332.12 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 79.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 332.11948 |
| Heavy Atoms | 23 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 766527-36-0 |
|---|---|
| SMILES | COC(=O)C1=C(C=CC(=C1)NCC2=CC=CS2)N3CCOCC3 |
| InChIKey | HSLSWLOVDVSQGB-UHFFFAOYSA-N |
Product Overview
Methyl 2-(4-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate (CAS 766527-36-0), with molecular formula C17H20N2O3S and molecular weight 332.12 g/mol. IUPAC: methyl 2-morpholin-4-yl-5-(thiophen-2-ylmethylamino)benzoate.
Chemical Property Profile of Methyl 2-(4-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate
Property Insights of Methyl 2-(4-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-(4-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate. The TPSA of 79.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(4-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate. Following Lipinski's Rule of Five, Methyl 2-(4-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate has 1 hydrogen bond donor(s) and 6 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-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate?
The CAS number of Methyl 2-(4-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate is 766527-36-0.
What is the molecular formula of Methyl 2-(4-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate?
The molecular formula of Methyl 2-(4-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate is C17H20N2O3S.
What is the molecular weight of Methyl 2-(4-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate?
The molecular weight of Methyl 2-(4-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate is 332.12 g/mol.
Where can I buy Methyl 2-(4-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate?
You can request a quote for Methyl 2-(4-morpholinyl)-5-[(2-thienylmethyl)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 2-(4-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(4-morpholinyl)-5-[(2-thienylmethyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.