BAS 01313335
TL;DR: BAS 01313335 (CAS 353778-87-7) is a chemical compound with molecular formula C25H26BrNO3 and molecular weight 467.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzodioxol-5-yl)-N-[(4-bromophenyl)methyl]-N-[(4-ethoxyphenyl)methyl]ethanamine
Also Known As: BAS 01313335, 2-(1,3-benzodioxol-5-yl)-N-[(4-bromophenyl)methyl]-N-[(4-ethoxyphenyl)methyl]ethanamine, (2-Benzo[1,3]dioxol-5-yl-ethyl)-(4-bromo-benzyl)-(4-ethoxy-benzyl)-amine, [2-(2H-1,3-BENZODIOXOL-5-YL)ETHYL][(4-BROMOPHENYL)METHYL][(4-ETHOXYPHENYL)METHYL]AMINE, 2-(1,3-benzodioxol-5-yl)-N-(4-bromobenzyl)-N-(4-ethoxybenzyl)ethanamine
| Molecular Formula | C25H26BrNO3 |
|---|---|
| Molecular Weight | 467.11 g/mol |
| LogP | 5.8214 |
| Topological Polar Surface Area | 30.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 467.10962 |
| Heavy Atoms | 30 |
| Complexity | 957.1327 |
Chemical Identifiers
| CAS Number | 353778-87-7 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)CN(CCC2=CC3=C(C=C2)OCO3)CC4=CC=C(C=C4)Br |
Product Overview
BAS 01313335 (CAS 353778-87-7), with molecular formula C25H26BrNO3 and molecular weight 467.11 g/mol. IUPAC: 2-(1,3-benzodioxol-5-yl)-N-[(4-bromophenyl)methyl]-N-[(4-ethoxyphenyl)methyl]ethanamine.
Chemical Property Profile of BAS 01313335
Property Insights of BAS 01313335
The XLogP value of 5.8214 indicates that BAS 01313335 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.93 Ų, BAS 01313335 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01313335 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01313335?
The CAS number of BAS 01313335 is 353778-87-7.
What is the molecular formula of BAS 01313335?
The molecular formula of BAS 01313335 is C25H26BrNO3.
What is the molecular weight of BAS 01313335?
The molecular weight of BAS 01313335 is 467.11 g/mol.
Where can I buy BAS 01313335?
You can request a quote for BAS 01313335 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01313335?
Yes, KEHONG BIO provides custom synthesis services for BAS 01313335 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.