Tilitriandrine
TL;DR: Tilitriandrine (CAS 120139-68-6) is a chemical compound with molecular formula C36H38N2O6 and molecular weight 594.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9,20,25-trimethoxy-15-methyl-23-oxa-15,30-diazaheptacyclo[22.6.2.13,7.18,12.114,18.027,31.022,33]pentatriaconta-3(35),4,6,8,10,12(34),18,20,22(33),24,26,31-dodecaene-6,21-diol
Also Known As: Tilitriandrin, Tilitriandrine, 9,20,25-trimethoxy-15-methyl-23-oxa-15,30-diazaheptacyclo[22.6.2.13,7.18,12.114,18.027,31.022,33]pentatriaconta-3(35),4,6,8,10,12(34),18,20,22(33),24,26,31-dodecaene-6,21-diol, 9,20,25-trimethoxy-15-methyl-23-oxa-15,30-diazaheptacyclo(22.6.2.13,7.18,12.114,18.027,31.022,33)pentatriaconta-3(35),4,6,8,10,12(34),18,20,22(33),24,26,31-dodecaene-6,21-diol, RefChem:190017
| Molecular Formula | C36H38N2O6 |
|---|---|
| Molecular Weight | 594.27 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 594.273 |
| Heavy Atoms | 44 |
| Complexity | 956.0 |
Chemical Identifiers
| CAS Number | 120139-68-6 |
|---|---|
| SMILES | CN1CCC2=CC(=C(C3=C2C1CC4=CC(=C(C=C4)OC)C5=C(C=CC(=C5)CC6C7=CC(=C(C=C7CCN6)OC)O3)O)O)OC |
| InChIKey | IXKWJOUSNXVCKD-UHFFFAOYSA-N |
Product Overview
Tilitriandrine (CAS 120139-68-6), with molecular formula C36H38N2O6 and molecular weight 594.27 g/mol. IUPAC: 9,20,25-trimethoxy-15-methyl-23-oxa-15,30-diazaheptacyclo[22.6.2.13,7.18,12.114,18.027,31.022,33]pentatriaconta-3(35),4,6,8,10,12(34),18,20,22(33),24,26,31-dodecaene-6,21-diol.
Chemical Property Profile of Tilitriandrine
Property Insights of Tilitriandrine
The XLogP value of 5.6 indicates that Tilitriandrine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Tilitriandrine. Following Lipinski's Rule of Five, Tilitriandrine has 3 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 Tilitriandrine?
The CAS number of Tilitriandrine is 120139-68-6.
What is the molecular formula of Tilitriandrine?
The molecular formula of Tilitriandrine is C36H38N2O6.
What is the molecular weight of Tilitriandrine?
The molecular weight of Tilitriandrine is 594.27 g/mol.
Where can I buy Tilitriandrine?
You can request a quote for Tilitriandrine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tilitriandrine?
Yes, KEHONG BIO provides custom synthesis services for Tilitriandrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.