BAS 04056382
TL;DR: BAS 04056382 (CAS 433953-40-3) is a chemical compound with molecular formula C25H33NO3 and molecular weight 395.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-3-(2,2-dimethyloxan-4-yl)-3-(4-methylphenyl)propan-1-amine
Also Known As: BAS 04056382, N-(1,3-benzodioxol-5-ylmethyl)-3-(2,2-dimethyloxan-4-yl)-3-(4-methylphenyl)propan-1-amine, N-(1,3-benzodioxol-5-ylmethyl)-3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-(4-methylphenyl)propan-1-amine
| Molecular Formula | C25H33NO3 |
|---|---|
| Molecular Weight | 395.25 g/mol |
| LogP | 5.19242 |
| Topological Polar Surface Area | 39.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 395.24603 |
| Heavy Atoms | 29 |
| Complexity | 815.31824 |
Chemical Identifiers
| CAS Number | 433953-40-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(CCNCC2=CC3=C(C=C2)OCO3)C4CCOC(C4)(C)C |
Product Overview
BAS 04056382 (CAS 433953-40-3), with molecular formula C25H33NO3 and molecular weight 395.25 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-3-(2,2-dimethyloxan-4-yl)-3-(4-methylphenyl)propan-1-amine.
Chemical Property Profile of BAS 04056382
Property Insights of BAS 04056382
The XLogP value of 5.19242 indicates that BAS 04056382 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 04056382 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 04056382 has 1 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 04056382?
The CAS number of BAS 04056382 is 433953-40-3.
What is the molecular formula of BAS 04056382?
The molecular formula of BAS 04056382 is C25H33NO3.
What is the molecular weight of BAS 04056382?
The molecular weight of BAS 04056382 is 395.25 g/mol.
Where can I buy BAS 04056382?
You can request a quote for BAS 04056382 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04056382?
Yes, KEHONG BIO provides custom synthesis services for BAS 04056382 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.