CAS RN: 180084-26-8
SB 224289 HYDROCHLORIDE
Product Availability
Choose a grade to view its available package options.
7 package records6 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250309 | 5mg / 10mg | Out of stock | 5-7 business days | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20251222 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20250313 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20260317 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20250622 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20250422 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20260425 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS180084-26-8
- Purity/Analytical Methods: >99.0%
180084-26-8 / [4-[2-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]phenyl]-(1'-methylspiro[6,7-dihydro-2H-furo[2,3-f]indole-3,4'-piperidine]-5-yl)methanone;hydrochloride
Basic Information
CAS
180084-26-8
Multi CAS
No
Molecular Formula
C32H33ClN4O3
Molecular Weight
557.100000
Exact Mass
556.224119
SMILES
CC1=C(C=CC(=C1)C2=NOC(=N2)C)C3=CC=C(C=C3)C(=O)N4CCC5=CC6=C(C=C54)C7(CCN(CC7)C)CO6.Cl
InChI
InChI=1S/C32H32N4O3.ClH/c1-20-16-25(30-33-21(2)39-34-30)8-9-26(20)22-4-6-23(7-5-22)31(37)36-13-10-24-17-29-27(18-28(24)36)32(19-38-29)11-14-35(3)15-12-32;/h4-9,16-18H,10-15,19H2,1-3H3;1H
InChIKey
GKGKBZYMDILCOF-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
40
Aromatic heavy atom count
23
Fraction Csp3
0.34
Rotatable bonds
3
H-bond acceptors
6
H-bond donors
1
Molar refractivity
157.62
TPSA
71.7
LogP / Solubility
WLOGP
6
MLOGP
5.32
XLogP3
6
Consensus LogP
5.77
Log S (ESOL)
-7.3
Class (ESOL)
Insoluble
Log S (Ali)
-8.46
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.62
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.86
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
7
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