2-(Dimethylamino)ethyl 4-(acetylamino)benzoate
TL;DR: 2-(Dimethylamino)ethyl 4-(acetylamino)benzoate (CAS 2811-31-6) is a chemical compound with molecular formula C13H18N2O3 and molecular weight 250.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylamino)ethyl 4-acetamidobenzoate
Also Known As: 2-(dimethylamino)ethyl 4-acetamidobenzoate, DEANOL ACETAMIDOBENZOATE, 2-(Dimethylamino)ethyl 4-(acetylamino)benzoate, 2-dimethylaminoethyl 4-acetamidobenzoate, 2-DIMETHYLAMINOETHYL P-ACETAMIDOBENZOATE
| Molecular Formula | C13H18N2O3 |
|---|---|
| Molecular Weight | 250.13 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 250.13174 |
| Heavy Atoms | 18 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 2811-31-6 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)C(=O)OCCN(C)C |
| InChIKey | FZLZGULUHIGIOT-UHFFFAOYSA-N |
Product Overview
2-(Dimethylamino)ethyl 4-(acetylamino)benzoate (CAS 2811-31-6), with molecular formula C13H18N2O3 and molecular weight 250.13 g/mol. IUPAC: 2-(dimethylamino)ethyl 4-acetamidobenzoate.
Chemical Property Profile of 2-(Dimethylamino)ethyl 4-(acetylamino)benzoate
Property Insights of 2-(Dimethylamino)ethyl 4-(acetylamino)benzoate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Dimethylamino)ethyl 4-(acetylamino)benzoate. With a topological polar surface area (TPSA) of 58.6 Ų, 2-(Dimethylamino)ethyl 4-(acetylamino)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Dimethylamino)ethyl 4-(acetylamino)benzoate has 1 hydrogen bond donor(s) and 4 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 2-(Dimethylamino)ethyl 4-(acetylamino)benzoate?
The CAS number of 2-(Dimethylamino)ethyl 4-(acetylamino)benzoate is 2811-31-6.
What is the molecular formula of 2-(Dimethylamino)ethyl 4-(acetylamino)benzoate?
The molecular formula of 2-(Dimethylamino)ethyl 4-(acetylamino)benzoate is C13H18N2O3.
What is the molecular weight of 2-(Dimethylamino)ethyl 4-(acetylamino)benzoate?
The molecular weight of 2-(Dimethylamino)ethyl 4-(acetylamino)benzoate is 250.13 g/mol.
Where can I buy 2-(Dimethylamino)ethyl 4-(acetylamino)benzoate?
You can request a quote for 2-(Dimethylamino)ethyl 4-(acetylamino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Dimethylamino)ethyl 4-(acetylamino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Dimethylamino)ethyl 4-(acetylamino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.