醋硝香豆醇
TL;DR: 醋硝香豆醇 (CAS 152-72-7) is a chemical compound with molecular formula C26H40N2 and molecular weight 380.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
醋硝香豆醇
1-[4-tert-butyl-2-[5-tert-butyl-2-[(dimethylamino)methyl]phenyl]phenyl]-N,N-dimethylmethanamine
Also Known As: NCIStruc1_001469, NCIStruc2_001662, KST-1A1629, NCI60_000641, (5,5'-ditert-butyl-2'-((dimethylamino)methyl)[1,1'-biphenyl]-2-yl)-N,N-dimethylmethanamine
| Molecular Formula | C26H40N2 |
|---|---|
| Molecular Weight | 380.32 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 6.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 380.31915 |
| Heavy Atoms | 28 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 152-72-7 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C=C1)CN(C)C)C2=C(C=CC(=C2)C(C)(C)C)CN(C)C |
| InChIKey | IBOBEXDBNVGMKY-UHFFFAOYSA-N |
Product Overview
醋硝香豆醇 (CAS 152-72-7), with molecular formula C26H40N2 and molecular weight 380.32 g/mol. IUPAC: 1-[4-tert-butyl-2-[5-tert-butyl-2-[(dimethylamino)methyl]phenyl]phenyl]-N,N-dimethylmethanamine.
Chemical Property Profile of 醋硝香豆醇
Property Insights of 醋硝香豆醇
The XLogP value of 6.6 indicates that 醋硝香豆醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.5 Ų, 醋硝香豆醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 醋硝香豆醇 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 醋硝香豆醇?
The CAS number of 醋硝香豆醇 is 152-72-7.
What is the molecular formula of 醋硝香豆醇?
The molecular formula of 醋硝香豆醇 is C26H40N2.
What is the molecular weight of 醋硝香豆醇?
The molecular weight of 醋硝香豆醇 is 380.32 g/mol.
Where can I buy 醋硝香豆醇?
You can request a quote for 醋硝香豆醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 醋硝香豆醇?
Yes, KEHONG BIO provides custom synthesis services for 醋硝香豆醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.