3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide
TL;DR: 3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide (CAS 384807-20-9) is a chemical compound with molecular formula C37H40N4O6 and molecular weight 636.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,2-dimethylpropanoylamino)-N-[4-[[4-[[3-(2,2-dimethylpropanoylamino)benzoyl]amino]-3-hydroxyphenyl]methyl]-2-hydroxyphenyl]benzamide
Also Known As: 3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide, 3-(2,2-dimethylpropanoylamino)-N-[4-[[4-[[3-(2,2-dimethylpropanoylamino)benzoyl]amino]-3-hydroxyphenyl]methyl]-2-hydroxyphenyl]benzamide
| Molecular Formula | C37H40N4O6 |
|---|---|
| Molecular Weight | 636.29 g/mol |
| LogP | 7.1624 |
| Topological Polar Surface Area | 156.86 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 636.2948 |
| Heavy Atoms | 47 |
| Complexity | 1702.509 |
Chemical Identifiers
| CAS Number | 384807-20-9 |
|---|---|
| SMILES | CC(C)(C)C(=O)NC1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)CC3=CC(=C(C=C3)NC(=O)C4=CC(=CC=C4)NC(=O)C(C)(C)C)O)O |
Product Overview
3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide (CAS 384807-20-9), with molecular formula C37H40N4O6 and molecular weight 636.29 g/mol. IUPAC: 3-(2,2-dimethylpropanoylamino)-N-[4-[[4-[[3-(2,2-dimethylpropanoylamino)benzoyl]amino]-3-hydroxyphenyl]methyl]-2-hydroxyphenyl]benzamide.
Chemical Property Profile of 3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide
Property Insights of 3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide
The XLogP value of 7.1624 indicates that 3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 156.86 Ų indicates high polarity, suggesting 3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide has 6 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide?
The CAS number of 3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide is 384807-20-9.
What is the molecular formula of 3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide?
The molecular formula of 3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide is C37H40N4O6.
What is the molecular weight of 3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide?
The molecular weight of 3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide is 636.29 g/mol.
Where can I buy 3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide?
You can request a quote for 3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-[(2,2-Dimethylpropanoyl)amino]-N-{4-[4-({3-[(2,2-dimethylpropanoyl)amino]benzoyl}amino)-3-hydroxybenzyl]-2-hydroxyphenyl}benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.