Tiodazosin levulinate
TL;DR: Tiodazosin levulinate (CAS 76798-65-7) is a chemical compound with molecular formula C24H31N7O7S and molecular weight 561.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(5-methylsulfanyl-1,3,4-oxadiazol-2-yl)methanone;5-oxohexanoic acid
Also Known As: Tiodazosin levulinate, [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(5-methylsulfanyl-1,3,4-oxadiazol-2-yl)methanone; 5-oxohexanoic acid, 5-Oxohexanoic acid--[4-(4-imino-6,7-dimethoxy-3,4-dihydroquinazolin-2-yl)piperazin-1-yl][5-(methylsulfanyl)-1,3,4-oxadiazol-2-yl]methanone (1/1)
| Molecular Formula | C24H31N7O7S |
|---|---|
| Molecular Weight | 561.20 g/mol |
| LogP | 2.1268 |
| Topological Polar Surface Area | 212.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 9 |
| Exact Mass | 561.20056 |
| Heavy Atoms | 39 |
| Complexity | 714.0 |
Chemical Identifiers
| CAS Number | 76798-65-7 |
|---|---|
| SMILES | CC(=O)CCCC(=O)O.COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4=NN=C(O4)SC)N)OC |
| InChIKey | LARNEZZIUYRMJC-UHFFFAOYSA-N |
Product Overview
Tiodazosin levulinate (CAS 76798-65-7), with molecular formula C24H31N7O7S and molecular weight 561.20 g/mol. IUPAC: [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(5-methylsulfanyl-1,3,4-oxadiazol-2-yl)methanone;5-oxohexanoic acid.
Chemical Property Profile of Tiodazosin levulinate
Property Insights of Tiodazosin levulinate
The XLogP value of 2.1268 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tiodazosin levulinate. The TPSA of 212.0 Ų indicates high polarity, suggesting Tiodazosin levulinate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tiodazosin levulinate has 2 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tiodazosin levulinate?
The CAS number of Tiodazosin levulinate is 76798-65-7.
What is the molecular formula of Tiodazosin levulinate?
The molecular formula of Tiodazosin levulinate is C24H31N7O7S.
What is the molecular weight of Tiodazosin levulinate?
The molecular weight of Tiodazosin levulinate is 561.20 g/mol.
Where can I buy Tiodazosin levulinate?
You can request a quote for Tiodazosin levulinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tiodazosin levulinate?
Yes, KEHONG BIO provides custom synthesis services for Tiodazosin levulinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.