3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride
TL;DR: 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride (CAS 65193-76-2) is a chemical compound with molecular formula C23H33ClN2O4 and molecular weight 436.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-trimethyl-5-[1-(1-phenylpropan-2-ylamino)butan-2-yloxycarbonyl]-1,4-dihydropyridine-3-carboxylic acid;hydrochloride
Also Known As: 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride, 2,4,6-Trimethyl-5-[({1-[(1-phenylpropan-2-yl)amino]butan-2-yl}oxy)carbonyl]-1,4-dihydropyridine-3-carboxylic acid--hydrogen chloride (1/1), 2,4,6-trimethyl-5-[1-(1-phenylpropan-2-ylamino)butan-2-yloxycarbonyl]-1,4-dihydropyridine-3-carboxylic acid hydrochloride, RefChem:272114
| Molecular Formula | C23H33ClN2O4 |
|---|---|
| Molecular Weight | 436.21 g/mol |
| LogP | 3.8227 |
| Topological Polar Surface Area | 87.66 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 436.2129 |
| Heavy Atoms | 30 |
| Complexity | 804.68097 |
Chemical Identifiers
| CAS Number | 65193-76-2 |
|---|---|
| SMILES | CCC(CNC(C)CC1=CC=CC=C1)OC(=O)C2=C(NC(=C(C2C)C(=O)O)C)C.Cl |
Product Overview
3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride (CAS 65193-76-2), with molecular formula C23H33ClN2O4 and molecular weight 436.21 g/mol. IUPAC: 2,4,6-trimethyl-5-[1-(1-phenylpropan-2-ylamino)butan-2-yloxycarbonyl]-1,4-dihydropyridine-3-carboxylic acid;hydrochloride.
Chemical Property Profile of 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride
Property Insights of 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride
The XLogP value of 3.8227 indicates that 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride. Following Lipinski's Rule of Five, 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride has 3 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 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride?
The CAS number of 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride is 65193-76-2.
What is the molecular formula of 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride?
The molecular formula of 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride is C23H33ClN2O4.
What is the molecular weight of 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride?
The molecular weight of 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride is 436.21 g/mol.
Where can I buy 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride?
You can request a quote for 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, ethyl 2-(alpha-methylphenethylamino)ethyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.