![(E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one structure](/static/products/3719/371946-69-9.webp)
(E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one
TL;DR: (E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one (CAS 371946-69-9) is a chemical compound with molecular formula C24H23ClN4OS2 and molecular weight 482.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-4-(cyclohexyliminomethyl)-1H-pyrazol-3-one
Also Known As: (E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one, (4Z)-2-(1,3-benzothiazol-2-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-4-[(cyclohexylamino)methylidene]-2,4-dihydro-3H-pyrazol-3-one, 2-(1,3-Benzothiazol-2-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-4-(cyclohexyliminomethyl)-1H-pyrazol-3-one, 2-(1,3-benzothiazol-2-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-4-[(cyclohexylimino)methyl]-1,2-dihydro-3H-pyrazol-3-one, (4E)-2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-4-[(cyclohexylamino)methylidene]pyrazol-3-one
| Molecular Formula | C24H23ClN4OS2 |
|---|---|
| Molecular Weight | 482.10 g/mol |
| LogP | 6.4726 |
| Topological Polar Surface Area | 63.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 482.1002 |
| Heavy Atoms | 32 |
| Complexity | 1266.7855 |
Chemical Identifiers
| CAS Number | 371946-69-9 |
|---|---|
| SMILES | C1CCC(CC1)N=CC2=C(NN(C2=O)C3=NC4=CC=CC=C4S3)CSC5=CC=C(C=C5)Cl |
Product Overview
(E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one (CAS 371946-69-9), with molecular formula C24H23ClN4OS2 and molecular weight 482.10 g/mol. IUPAC: 2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-4-(cyclohexyliminomethyl)-1H-pyrazol-3-one.
Chemical Property Profile of (E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one
Property Insights of (E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one
The XLogP value of 6.4726 indicates that (E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.04 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one. Following Lipinski's Rule of Five, (E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one?
The CAS number of (E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one is 371946-69-9.
What is the molecular formula of (E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one?
The molecular formula of (E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one is C24H23ClN4OS2.
What is the molecular weight of (E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one?
The molecular weight of (E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one is 482.10 g/mol.
Where can I buy (E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one?
You can request a quote for (E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-(benzo[d]thiazol-2-yl)-5-(((4-chlorophenyl)thio)methyl)-4-((cyclohexylimino)methyl)-1H-pyrazol-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.