RefChem:95731
TL;DR: RefChem:95731 (CAS 67663-00-7) is a chemical compound with molecular formula C28H36N2O and molecular weight 416.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dimethyl-8,8-bis(3-methylindol-3-yl)octan-2-ol
Also Known As: 2,6-Dimethyl-8,8-bis(3-methyl-3H-indol-3-yl)-2-octanol, 2,6-dimethyl-8,8-bis(3-methyl-3H-indol-3-yl)octan-2-ol, 3H-Indole-3-heptanol, .alpha.,.alpha.,.epsilon.,3-tetramethyl-.eta.-(3-methyl-3H-indol-3-yl)-, 3H-Indole-3-heptanol, alpha,alpha,epsilon,3-tetramethyl-eta-(3-methyl-3H-indol-3-yl)-, 2,6-dimethyl-8,8-bis(3-methylindol-3-yl)octan-2-ol
| Molecular Formula | C28H36N2O |
|---|---|
| Molecular Weight | 416.28 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 45.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 416.28278 |
| Heavy Atoms | 31 |
| Complexity | 640.0 |
Chemical Identifiers
| CAS Number | 67663-00-7 |
|---|---|
| SMILES | CC(CCCC(C)(C)O)CC(C1(C=NC2=CC=CC=C21)C)C3(C=NC4=CC=CC=C43)C |
| InChIKey | LRPMXGLOVFPBKD-UHFFFAOYSA-N |
Product Overview
RefChem:95731 (CAS 67663-00-7), with molecular formula C28H36N2O and molecular weight 416.28 g/mol. IUPAC: 2,6-dimethyl-8,8-bis(3-methylindol-3-yl)octan-2-ol.
Chemical Property Profile of RefChem:95731
Property Insights of RefChem:95731
The XLogP value of 5.4 indicates that RefChem:95731 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.0 Ų, RefChem:95731 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:95731 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:95731?
The CAS number of RefChem:95731 is 67663-00-7.
What is the molecular formula of RefChem:95731?
The molecular formula of RefChem:95731 is C28H36N2O.
What is the molecular weight of RefChem:95731?
The molecular weight of RefChem:95731 is 416.28 g/mol.
Where can I buy RefChem:95731?
You can request a quote for RefChem:95731 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:95731?
Yes, KEHONG BIO provides custom synthesis services for RefChem:95731 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.