Carbanilic acid, 4-(hexyloxy)-2-methyl-, 1-((diethylamino)methyl)ethyl ester
TL;DR: Carbanilic acid, 4-(hexyloxy)-2-methyl-, 1-((diethylamino)methyl)ethyl ester (CAS 63986-57-2) is a chemical compound with molecular formula C21H36N2O3 and molecular weight 364.27258 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(diethylamino)propan-2-yl N-(4-hexoxy-2-methylphenyl)carbamate
Also Known As: KL 3831, 1-((Diethylamino)methyl)ethyl 4-(hexyloxy)-2-methylcarbanilate, 4-(Hexyloxy)-2-methylcarbanilic acid 1-((diethylamino)methyl)ethyl ester, 1-(diethylamino)propan-2-yl N-(4-hexoxy-2-methylphenyl)carbamate, CARBANILIC ACID, 4-(HEXYLOXY)-2-METHYL-, 1-((DIETHYLAMINO)METHYL)ETHYL ESTER
Technical Specifications
| Molecular Formula | C21H36N2O3 |
| Molecular Weight | 364.27258 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 364.27258 Da |
| Heavy Atoms | 26 |
| Complexity | 374.0 |
| SMILES | CCCCCCOC1=CC(=C(C=C1)NC(=O)OC(C)CN(CC)CC)C |
| InChIKey | WZKHEEMESQKECF-UHFFFAOYSA-N |
Chemical Property Profile of Carbanilic acid, 4-(hexyloxy)-2-methyl-, 1-((diethylamino)methyl)ethyl ester
Property Insights of Carbanilic acid, 4-(hexyloxy)-2-methyl-, 1-((diethylamino)methyl)ethyl ester
The XLogP value of 5.4 indicates that Carbanilic acid, 4-(hexyloxy)-2-methyl-, 1-((diethylamino)methyl)ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.8 Ų, Carbanilic acid, 4-(hexyloxy)-2-methyl-, 1-((diethylamino)methyl)ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbanilic acid, 4-(hexyloxy)-2-methyl-, 1-((diethylamino)methyl)ethyl ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Carbanilic acid, 4-(hexyloxy)-2-methyl-, 1-((diethylamino)methyl)ethyl ester?
The CAS number of Carbanilic acid, 4-(hexyloxy)-2-methyl-, 1-((diethylamino)methyl)ethyl ester is 63986-57-2.
What is the molecular formula of Carbanilic acid, 4-(hexyloxy)-2-methyl-, 1-((diethylamino)methyl)ethyl ester?
The molecular formula of Carbanilic acid, 4-(hexyloxy)-2-methyl-, 1-((diethylamino)methyl)ethyl ester is C21H36N2O3.
What is the molecular weight of Carbanilic acid, 4-(hexyloxy)-2-methyl-, 1-((diethylamino)methyl)ethyl ester?
The molecular weight of Carbanilic acid, 4-(hexyloxy)-2-methyl-, 1-((diethylamino)methyl)ethyl ester is 364.27258 g/mol.
Where can I buy Carbanilic acid, 4-(hexyloxy)-2-methyl-, 1-((diethylamino)methyl)ethyl ester?
You can request a quote for Carbanilic acid, 4-(hexyloxy)-2-methyl-, 1-((diethylamino)methyl)ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carbanilic acid, 4-(hexyloxy)-2-methyl-, 1-((diethylamino)methyl)ethyl ester?
Yes, CoreyChem provides custom synthesis services for Carbanilic acid, 4-(hexyloxy)-2-methyl-, 1-((diethylamino)methyl)ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.