![2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide structure](/static/products/1022/1022618-91-2.webp)
2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide
TL;DR: 2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide (CAS 1022618-91-2) is a chemical compound with molecular formula C38H39N3O5S and molecular weight 649.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[1,3-benzodioxol-5-ylmethyl-[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-1,3-thiazole-4-carboxamide
Also Known As: 2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide, 2-[[1,3-benzodioxol-5-ylmethyl-[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-1,3-thiazole-4-carboxamide
| Molecular Formula | C38H39N3O5S |
|---|---|
| Molecular Weight | 649.26 g/mol |
| LogP | 7.0859 |
| Topological Polar Surface Area | 82.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 15 |
| Exact Mass | 649.26105 |
| Heavy Atoms | 47 |
| Complexity | 1722.714 |
Chemical Identifiers
| CAS Number | 1022618-91-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN(CC2=CC3=C(C=C2)OCO3)CC4=NC(=CS4)C(=O)NCCC(C5=CC=CC=C5)C6=CC=CC=C6)OC |
Product Overview
2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide (CAS 1022618-91-2), with molecular formula C38H39N3O5S and molecular weight 649.26 g/mol. IUPAC: 2-[[1,3-benzodioxol-5-ylmethyl-[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-1,3-thiazole-4-carboxamide.
Chemical Property Profile of 2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide
Property Insights of 2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide
The XLogP value of 7.0859 indicates that 2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide. Following Lipinski's Rule of Five, 2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide?
The CAS number of 2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide is 1022618-91-2.
What is the molecular formula of 2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide?
The molecular formula of 2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide is C38H39N3O5S.
What is the molecular weight of 2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide?
The molecular weight of 2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide is 649.26 g/mol.
Where can I buy 2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide?
You can request a quote for 2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[[(1,3-Benzodioxol-5-ylmethyl)[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.