![(E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one structure](/static/products/371/371220-30-3.webp)
(E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one
TL;DR: (E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one (CAS 371220-30-3) is a chemical compound with molecular formula C27H23ClN4O2S2 and molecular weight 534.0951 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-4-[N-(2-ethoxyphenyl)-C-methylcarbonimidoyl]-1H-pyrazol-3-one
Also Known As: (E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one, (4E)-2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-4-[1-(2-ethoxyanilino)ethylidene]pyrazol-3-one, 1-(1,3-benzothiazol-2-yl)-3-{[(4-chlorophenyl)sulfanyl]methyl}-4-[(1E)-N-(2-ethoxyphenyl)ethanimidoyl]-1H-pyrazol-5-ol, 2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-4-[1-(2-ethoxyanilino)ethylidene]pyrazol-3-one
Technical Specifications
| Molecular Formula | C27H23ClN4O2S2 |
| Molecular Weight | 534.0951 g/mol |
| XLogP | 7.0 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 534.0951 Da |
| Heavy Atoms | 36 |
| Complexity | 848.0 |
| SMILES | CCOC1=CC=CC=C1N=C(C)C2=C(NN(C2=O)C3=NC4=CC=CC=C4S3)CSC5=CC=C(C=C5)Cl |
| InChIKey | DGGLMODLRSVWLQ-UHFFFAOYSA-N |
Chemical Property Profile of (E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one
Property Insights of (E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one
The XLogP value of 7.0 indicates that (E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one. Following Lipinski's Rule of Five, (E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of (E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one?
The CAS number of (E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one is 371220-30-3.
What is the molecular formula of (E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one?
The molecular formula of (E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one is C27H23ClN4O2S2.
What is the molecular weight of (E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one?
The molecular weight of (E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one is 534.0951 g/mol.
Where can I buy (E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one?
You can request a quote for (E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one?
Yes, CoreyChem provides custom synthesis services for (E)-1-(benzo[d]thiazol-2-yl)-3-(((4-chlorophenyl)thio)methyl)-4-(1-((2-ethoxyphenyl)amino)ethylidene)-1H-pyrazol-5(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.