![(4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone structure](/static/products/690/690990-99-9.png)
(4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone
TL;DR: (4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone (CAS 690990-99-9) is a chemical compound with molecular formula C22H19ClN4O2S and molecular weight 438.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]methanone
Also Known As: (4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone, [4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]methanone, [4-(1,3-benzothiazol-2-yl)piperazin-1-yl][3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]methanone, Cambridge id 7356040
| Molecular Formula | C22H19ClN4O2S |
|---|---|
| Molecular Weight | 438.09 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 90.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 438.09174 |
| Heavy Atoms | 30 |
| Complexity | 620.0 |
Chemical Identifiers
| CAS Number | 690990-99-9 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)N3CCN(CC3)C4=NC5=CC=CC=C5S4 |
| InChIKey | YQWJEZFAPQMPSV-UHFFFAOYSA-N |
Product Overview
(4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone (CAS 690990-99-9), with molecular formula C22H19ClN4O2S and molecular weight 438.09 g/mol. IUPAC: [4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]methanone.
Chemical Property Profile of (4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone
Property Insights of (4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone
The XLogP value of 4.9 indicates that (4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone. Following Lipinski's Rule of Five, (4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone has 0 hydrogen bond donor(s) and 6 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 (4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone?
The CAS number of (4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone is 690990-99-9.
What is the molecular formula of (4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone?
The molecular formula of (4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone is C22H19ClN4O2S.
What is the molecular weight of (4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone?
The molecular weight of (4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone is 438.09 g/mol.
Where can I buy (4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone?
You can request a quote for (4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.