Carbanilic acid, 4-(hexyloxy)-2-methyl-, 2-(dimethylamino)ethyl ester
TL;DR: Carbanilic acid, 4-(hexyloxy)-2-methyl-, 2-(dimethylamino)ethyl ester (CAS 63986-39-0) is a chemical compound with molecular formula C18H30N2O3 and molecular weight 322.22565 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(dimethylamino)ethyl N-(4-hexoxy-2-methylphenyl)carbamate
Also Known As: KL 3811, 2-(Dimethylamino)ethyl 4-(hexyloxy)-2-methylcarbanilate, CARBANILIC ACID, 4-(HEXYLOXY)-2-METHYL-, 2-(DIMETHYLAMINO)ETHYL ESTER, 2-dimethylaminoethyl N-(4-hexoxy-2-methylphenyl)carbamate, 4-(Hexyloxy)-2-methylcarbanilic acid 2-(dimethylamino)ethyl ester
Technical Specifications
| Molecular Formula | C18H30N2O3 |
| Molecular Weight | 322.22565 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 322.22565 Da |
| Heavy Atoms | 23 |
| Complexity | 323.0 |
| SMILES | CCCCCCOC1=CC(=C(C=C1)NC(=O)OCCN(C)C)C |
| InChIKey | STOXICLIVXPABV-UHFFFAOYSA-N |
Chemical Property Profile of Carbanilic acid, 4-(hexyloxy)-2-methyl-, 2-(dimethylamino)ethyl ester
Property Insights of Carbanilic acid, 4-(hexyloxy)-2-methyl-, 2-(dimethylamino)ethyl ester
The XLogP value of 4.2 indicates that Carbanilic acid, 4-(hexyloxy)-2-methyl-, 2-(dimethylamino)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-, 2-(dimethylamino)ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbanilic acid, 4-(hexyloxy)-2-methyl-, 2-(dimethylamino)ethyl ester 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
What is the CAS number of Carbanilic acid, 4-(hexyloxy)-2-methyl-, 2-(dimethylamino)ethyl ester?
The CAS number of Carbanilic acid, 4-(hexyloxy)-2-methyl-, 2-(dimethylamino)ethyl ester is 63986-39-0.
What is the molecular formula of Carbanilic acid, 4-(hexyloxy)-2-methyl-, 2-(dimethylamino)ethyl ester?
The molecular formula of Carbanilic acid, 4-(hexyloxy)-2-methyl-, 2-(dimethylamino)ethyl ester is C18H30N2O3.
What is the molecular weight of Carbanilic acid, 4-(hexyloxy)-2-methyl-, 2-(dimethylamino)ethyl ester?
The molecular weight of Carbanilic acid, 4-(hexyloxy)-2-methyl-, 2-(dimethylamino)ethyl ester is 322.22565 g/mol.
Where can I buy Carbanilic acid, 4-(hexyloxy)-2-methyl-, 2-(dimethylamino)ethyl ester?
You can request a quote for Carbanilic acid, 4-(hexyloxy)-2-methyl-, 2-(dimethylamino)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-, 2-(dimethylamino)ethyl ester?
Yes, CoreyChem provides custom synthesis services for Carbanilic acid, 4-(hexyloxy)-2-methyl-, 2-(dimethylamino)ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.