BAS 12766420
TL;DR: BAS 12766420 (CAS 858762-44-4) is a chemical compound with molecular formula C21H35NO3 and molecular weight 349.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,4-dimethoxyphenyl)methyl]-2-(2,2-dimethyl-4-propan-2-yloxan-4-yl)ethanamine
Also Known As: BAS 12766420, A4016/0171267, N-(3,4-dimethoxybenzyl)-2-(4-isopropyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine, N-[(3,4-dimethoxyphenyl)methyl]-2-(2,2-dimethyl-4-propan-2-yloxan-4-yl)ethanamine, [(3,4-DIMETHOXYPHENYL)METHYL]({2-[2,2-DIMETHYL-4-(PROPAN-2-YL)OXAN-4-YL]ETHYL})AMINE
| Molecular Formula | C21H35NO3 |
|---|---|
| Molecular Weight | 349.26 g/mol |
| LogP | 4.4149 |
| Topological Polar Surface Area | 39.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 349.2617 |
| Heavy Atoms | 25 |
| Complexity | 556.0722 |
Chemical Identifiers
| CAS Number | 858762-44-4 |
|---|---|
| SMILES | CC(C)C1(CCOC(C1)(C)C)CCNCC2=CC(=C(C=C2)OC)OC |
Product Overview
BAS 12766420 (CAS 858762-44-4), with molecular formula C21H35NO3 and molecular weight 349.26 g/mol. IUPAC: N-[(3,4-dimethoxyphenyl)methyl]-2-(2,2-dimethyl-4-propan-2-yloxan-4-yl)ethanamine.
Chemical Property Profile of BAS 12766420
Property Insights of BAS 12766420
The XLogP value of 4.4149 indicates that BAS 12766420 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.72 Ų, BAS 12766420 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 12766420 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
Frequently Asked Questions
What is the CAS number of BAS 12766420?
The CAS number of BAS 12766420 is 858762-44-4.
What is the molecular formula of BAS 12766420?
The molecular formula of BAS 12766420 is C21H35NO3.
What is the molecular weight of BAS 12766420?
The molecular weight of BAS 12766420 is 349.26 g/mol.
Where can I buy BAS 12766420?
You can request a quote for BAS 12766420 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12766420?
Yes, KEHONG BIO provides custom synthesis services for BAS 12766420 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.