![CAS 1370448-25-1 4-(4-(1-isopropyl-7-oxo-1,4,6,7-tetrahydrospiro[indazole-5,4′-piperidine]-1′-carbonyl)-6-methoxypyridin-2-yl)benzoicacid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1370448-25-1.gif)
CAS RN: 1370448-25-1
4-(4-(1-isopropyl-7-oxo-1,4,6,7-tetrahydrospiro[indazole-5,4′-piperidine]-1′-carbonyl)-6-methoxypyridin-2-yl)benzoicacid
Product Availability
Choose a grade to view its available package options.
8 package records8 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250806 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20250916 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20251216 | 1g | In stock | Shanghai | Inquiry |
| Batchno.20250908 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20250121 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20250708 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20250218 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20260517 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS1370448-25-1
- Purity/Analytical Methods: >99.0%
1370448-25-1 / 4-[6-methoxy-4-(7-oxo-1-propan-2-ylspiro[4,6-dihydroindazole-5,4'-piperidine]-1'-carbonyl)-2-pyridinyl]benzoic acid
Basic Information
CAS
1370448-25-1
Multi CAS
No
Molecular Formula
C28H30N4O5
Molecular Weight
502.600000
Exact Mass
502.221620
SMILES
CC(C)N1C2=C(CC3(CCN(CC3)C(=O)C4=CC(=NC(=C4)OC)C5=CC=C(C=C5)C(=O)O)CC2=O)C=N1
InChI
InChI=1S/C28H30N4O5/c1-17(2)32-25-21(16-29-32)14-28(15-23(25)33)8-10-31(11-9-28)26(34)20-12-22(30-24(13-20)37-3)18-4-6-19(7-5-18)27(35)36/h4-7,12-13,16-17H,8-11,14-15H2,1-3H3,(H,35,36)
InChIKey
LXZMHBHEXAELHH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
37
Aromatic heavy atom count
17
Fraction Csp3
0.39
Rotatable bonds
5
H-bond acceptors
7
H-bond donors
1
Molar refractivity
136.02
TPSA
114.62
LogP / Solubility
WLOGP
4.28
MLOGP
3.81
XLogP3
3.2
Consensus LogP
3.76
Log S (ESOL)
-5.67
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.77
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.08
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.74
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
6
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