![[2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate structure](/static/products/4816/481677-39-8.webp)
[2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate
TL;DR: [2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate (CAS 481677-39-8) is a chemical compound with molecular formula C20H24ClNO3 and molecular weight 361.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate
Also Known As: [2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate|2-[Methyl(phenyl)amino]-2-oxoethyl 3-chloroadamantane-1-carboxylate|MLS002245323|SMR001308976
| Molecular Formula | C20H24ClNO3 |
|---|---|
| Molecular Weight | 361.14 g/mol |
| LogP | 3.7704 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 361.14447 |
| Heavy Atoms | 25 |
| Complexity | 675.4415 |
Chemical Identifiers
| CAS Number | 481677-39-8 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)C(=O)COC(=O)C23CC4CC(C2)CC(C4)(C3)Cl |
Product Overview
[2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate (CAS 481677-39-8), with molecular formula C20H24ClNO3 and molecular weight 361.14 g/mol. IUPAC: [2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate.
Chemical Property Profile of [2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate
Property Insights of [2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate
The XLogP value of 3.7704 indicates that [2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, [2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate has 0 hydrogen bond donor(s) and 3 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-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate?
The CAS number of [2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate is 481677-39-8.
What is the molecular formula of [2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate?
The molecular formula of [2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate is C20H24ClNO3.
What is the molecular weight of [2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate?
The molecular weight of [2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate is 361.14 g/mol.
Where can I buy [2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate?
You can request a quote for [2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [2-(N-methylanilino)-2-oxoethyl] 3-chloroadamantane-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.