5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one
TL;DR: 5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one (CAS 617694-57-2) is a chemical compound with molecular formula C22H21N3O2S and molecular weight 391.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(2-pentoxyphenyl)methylidene]-2-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
Also Known As: (Z)-5-(2-(pentyloxy)benzylidene)-2-phenylthiazolo[3,2-b][1,2,4]triazol-6(5H)-one, 5-(2-(Pentyloxy)benzylidene)-2-phenylthiazolo[3,2-b][1,2,4]triazol-6(5H)-one, (5Z)-5-[(2-pentoxyphenyl)methylidene]-2-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one, 5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one, (5Z)-5-{[2-(PENTYLOXY)PHENYL]METHYLIDENE}-2-PHENYL-5H,6H-[1,2,4]TRIAZOLO[3,2-B][1,3]THIAZOL-6-ONE
| Molecular Formula | C22H21N3O2S |
|---|---|
| Molecular Weight | 391.14 g/mol |
| LogP | 3.9347 |
| Topological Polar Surface Area | 56.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 391.13544 |
| Heavy Atoms | 28 |
| Complexity | 1181.6917 |
Chemical Identifiers
| CAS Number | 617694-57-2 |
|---|---|
| SMILES | CCCCCOC1=CC=CC=C1/C=C\2/C(=O)N3C(=NC(=N3)C4=CC=CC=C4)S2 |
Product Overview
5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one (CAS 617694-57-2), with molecular formula C22H21N3O2S and molecular weight 391.14 g/mol. IUPAC: (5Z)-5-[(2-pentoxyphenyl)methylidene]-2-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one.
Chemical Property Profile of 5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one
Property Insights of 5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one
The XLogP value of 3.9347 indicates that 5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.49 Ų, 5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one has 0 hydrogen bond donor(s) and 5 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 5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one?
The CAS number of 5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one is 617694-57-2.
What is the molecular formula of 5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one?
The molecular formula of 5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one is C22H21N3O2S.
What is the molecular weight of 5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one?
The molecular weight of 5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one is 391.14 g/mol.
Where can I buy 5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one?
You can request a quote for 5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-(Pentyloxy)benzylidene)-2-PH(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.