Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride
TL;DR: Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride (CAS 14034-41-4) is a chemical compound with molecular formula C14H21ClN2O4 and molecular weight 316.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-hydroxy-4-[[2-(propan-2-ylamino)acetyl]amino]benzoate;hydrochloride
Also Known As: 4-(2-(Isopropylamino)acetamido)salicylic acid ethyl ester hydrochloride, Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride, ethyl 2-hydroxy-4-[[2-(propan-2-ylamino)acetyl]amino]benzoate hydrochloride, Ethyl 2-hydroxy-4-{[N-(propan-2-yl)glycyl]amino}benzoate--hydrogen chloride (1/1), RefChem:379804
| Molecular Formula | C14H21ClN2O4 |
|---|---|
| Molecular Weight | 316.12 g/mol |
| LogP | 1.9272 |
| Topological Polar Surface Area | 87.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 316.119 |
| Heavy Atoms | 21 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 14034-41-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(C=C(C=C1)NC(=O)CNC(C)C)O.Cl |
| InChIKey | OBRNZLNSWOHHEW-UHFFFAOYSA-N |
Product Overview
Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride (CAS 14034-41-4), with molecular formula C14H21ClN2O4 and molecular weight 316.12 g/mol. IUPAC: ethyl 2-hydroxy-4-[[2-(propan-2-ylamino)acetyl]amino]benzoate;hydrochloride.
Chemical Property Profile of Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride
Property Insights of Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride
The XLogP value of 1.9272 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride. Following Lipinski's Rule of Five, Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride has 4 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 Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride?
The CAS number of Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride is 14034-41-4.
What is the molecular formula of Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride?
The molecular formula of Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride is C14H21ClN2O4.
What is the molecular weight of Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride?
The molecular weight of Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride is 316.12 g/mol.
Where can I buy Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride?
You can request a quote for Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Salicylic acid, 4-(2-(isopropylamino)acetamido)-, ethyl ester, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.