CAS RN: 893449-38-2
PRL-3 INHIBITOR I
Product Availability
Choose a grade to view its available package options.
5 package records3 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250125 | 100mg | In stock | Tianjin | Inquiry | |
| Batchno.20260507 | 1g | Out of stock | Inquiry | ||
| Batchno.20250119 | 250mg | Out of stock | Inquiry | ||
| Batchno.20250510 | 50mg | In stock | Tianjin | Inquiry | |
| Batchno.20251010 | 50mg / 100mg / 250mg / 1g | Confirm by inquiry | Shanghai | 5-7 business days | Inquiry |
- Product code: starshine_CAS893449-38-2
- Purity/Analytical Methods: >99.0%
893449-38-2 / (5Z)-5-[[5-bromo-2-[(2-bromophenyl)methoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Basic Information
CAS
893449-38-2
Multi CAS
Yes
Molecular Formula
C17H11BR2NO2S2
Molecular Weight
485.200000
Exact Mass
484.857750
InChI
InChI=1S/C17H11Br2NO2S2/c18-12-5-6-14(22-9-10-3-1-2-4-13(10)19)11(7-12)8-15-16(21)20-17(23)24-15/h1-8H,9H2,(H,20,21,23)/b15-8-
InChIKey
HXNBAOLVPAWYLT-NVNXTCNLSA-N
Computed Properties
Structural Parameters
Heavy atom count
24
Aromatic heavy atom count
12
Fraction Csp3
0.06
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
1
Molar refractivity
108.92
TPSA
38.33
LogP / Solubility
WLOGP
5.28
MLOGP
4.68
XLogP3
5.6
Consensus LogP
5.19
Log S (ESOL)
-6.28
Class (ESOL)
Insoluble
Log S (Ali)
-7.35
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.68
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.93
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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