Benzastatin I
TL;DR: Benzastatin I (CAS 357931-75-0) is a chemical compound with molecular formula C18H26N2O2 and molecular weight 302.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-3-[(2E,6Z)-8-hydroxy-3,6,7-trimethylocta-2,6-dienyl]benzamide
Also Known As: Benzastatin I, J1.568.958G, 4-amino-3-[(2E,6Z)-8-hydroxy-3,6,7-trimethylocta-2,6-dienyl]benzamide, 4-amino-3-((2E,6Z)-8-hydroxy-3,6,7-trimethylocta-2,6-dienyl)benzamide, 4-amino-3-[(2E,6Z)-8-hydroxy-3,6,7-trimethyl-octa-2,6-dienyl]benzamide
| Molecular Formula | C18H26N2O2 |
|---|---|
| Molecular Weight | 302.20 g/mol |
| LogP | 2.9654 |
| Topological Polar Surface Area | 89.34 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 302.19943 |
| Heavy Atoms | 22 |
| Complexity | 601.10474 |
Chemical Identifiers
| CAS Number | 357931-75-0 |
|---|---|
| SMILES | C/C(=C\CC1=C(C=CC(=C1)C(=O)N)N)/CC/C(=C(/C)\CO)/C |
Product Overview
Benzastatin I (CAS 357931-75-0), with molecular formula C18H26N2O2 and molecular weight 302.20 g/mol. IUPAC: 4-amino-3-[(2E,6Z)-8-hydroxy-3,6,7-trimethylocta-2,6-dienyl]benzamide.
Chemical Property Profile of Benzastatin I
Property Insights of Benzastatin I
The XLogP value of 2.9654 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzastatin I. The TPSA of 89.34 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzastatin I. Following Lipinski's Rule of Five, Benzastatin I has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzastatin I?
The CAS number of Benzastatin I is 357931-75-0.
What is the molecular formula of Benzastatin I?
The molecular formula of Benzastatin I is C18H26N2O2.
What is the molecular weight of Benzastatin I?
The molecular weight of Benzastatin I is 302.20 g/mol.
Where can I buy Benzastatin I?
You can request a quote for Benzastatin I directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzastatin I?
Yes, KEHONG BIO provides custom synthesis services for Benzastatin I and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.