3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone
TL;DR: 3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone (CAS 110821-51-7) is a chemical compound with molecular formula C26H33N3OS and molecular weight 435.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-benzylidene-3-[(dibutylamino)methyl]-2-(4-methylphenyl)imino-1,3-thiazolidin-4-one
Also Known As: 3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone, 4-Thiazolidinone, 3-((dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-, (5E)-5-benzylidene-3-[(dibutylamino)methyl]-2-(4-methylphenyl)imino-1,3-thiazolidin-4-one
| Molecular Formula | C26H33N3OS |
|---|---|
| Molecular Weight | 435.23 g/mol |
| LogP | 6.45872 |
| Topological Polar Surface Area | 35.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 435.23444 |
| Heavy Atoms | 31 |
| Complexity | 898.00916 |
Chemical Identifiers
| CAS Number | 110821-51-7 |
|---|---|
| SMILES | CCCCN(CCCC)CN1C(=O)/C(=C\C2=CC=CC=C2)/SC1=NC3=CC=C(C=C3)C |
Product Overview
3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone (CAS 110821-51-7), with molecular formula C26H33N3OS and molecular weight 435.23 g/mol. IUPAC: (5E)-5-benzylidene-3-[(dibutylamino)methyl]-2-(4-methylphenyl)imino-1,3-thiazolidin-4-one.
Chemical Property Profile of 3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone
Property Insights of 3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone
The XLogP value of 6.45872 indicates that 3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.91 Ų, 3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone?
The CAS number of 3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone is 110821-51-7.
What is the molecular formula of 3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone?
The molecular formula of 3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone is C26H33N3OS.
What is the molecular weight of 3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone?
The molecular weight of 3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone is 435.23 g/mol.
Where can I buy 3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone?
You can request a quote for 3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone?
Yes, KEHONG BIO provides custom synthesis services for 3-((Dibutylamino)methyl)-2-((4-methylphenyl)imino)-5-(phenylmethylene)-4-thiazolidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.