![CAS 1000669-72-6 [4-[2-(1H-Indazol-3-yl)ethenyl]phenyl]-1-piperazinylmethanone molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1000669-72-6.gif)
CAS RN: 1000669-72-6
[4-[2-(1H-Indazol-3-yl)ethenyl]phenyl]-1-piperazinylmethanone
Product Availability
Choose a grade to view its available package options.
10 package records6 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260325 | 5mg / 25mg / 100mg | Out of stock | 8-10 business days | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250722 | 100mg | Out of stock | Inquiry | ||
| Batchno.20260401 | 10mg | Out of stock | Inquiry | ||
| Batchno.20251225 | 1mg | In stock | Shanghai | Inquiry | |
| Batchno.20251204 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20260515 | 50mg | Out of stock | Inquiry | ||
| Batchno.20250510 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS1000669-72-6
- Purity/Analytical Methods: >99.0%
1000669-72-6 / [4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-piperazin-1-ylmethanone
KW-2449 | 1000669-72-6 | KW 2449
Basic Information
CAS
1000669-72-6
Multi CAS
Yes
Molecular Formula
C20H20N4O
Molecular Weight
332.400000
Exact Mass
332.163711
SMILES
C1CN(CCN1)C(=O)C2=CC=C(C=C2)/C=C/C3=NNC4=CC=CC=C43
InChI
InChI=1S/C20H20N4O/c25-20(24-13-11-21-12-14-24)16-8-5-15(6-9-16)7-10-19-17-3-1-2-4-18(17)22-23-19/h1-10,21H,11-14H2,(H,22,23)/b10-7+
InChIKey
YYLKKYCXAOBSRM-JXMROGBWSA-N
Synonyms
KW-2449
1000669-72-6
KW 2449
KW2449
Methanone, [4-[2-(1H-indazol-3-yl)ethenyl]phenyl]-1-piperazinyl-
Computed Properties
Structural Parameters
Heavy atom count
25
Aromatic heavy atom count
15
Fraction Csp3
0.2
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
2
Molar refractivity
100.24
TPSA
61.02
LogP / Solubility
WLOGP
2.78
MLOGP
2.46
XLogP3
2.7
Consensus LogP
2.65
Log S (ESOL)
-3.9
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.29
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.49
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.77
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3
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