CAS RN: 873652-48-3
GDC-0152
Product Availability
Choose a grade to view its available package options.
6 package records2 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260326 | 100mg | Out of stock | Inquiry | |
| Batchno.20260610 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250524 | 250mg | Out of stock | Inquiry | |
| Batchno.20250420 | 25mg | Out of stock | Inquiry | |
| Batchno.20251119 | 50mg | Out of stock | Inquiry | |
| Batchno.20260605 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS873652-48-3
- Purity/Analytical Methods: >99.0%
873652-48-3 / (2S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-N-(4-phenylthiadiazol-5-yl)pyrrolidine-2-carboxamide
Basic Information
CAS
873652-48-3
Multi CAS
Yes
Molecular Formula
C25H34N6O3S
Molecular Weight
498.600000
Exact Mass
498.241310
InChI
InChI=1S/C25H34N6O3S/c1-16(26-2)22(32)27-21(18-12-7-4-8-13-18)25(34)31-15-9-14-19(31)23(33)28-24-20(29-30-35-24)17-10-5-3-6-11-17/h3,5-6,10-11,16,18-19,21,26H,4,7-9,12-15H2,1-2H3,(H,27,32)(H,28,33)/t16-,19-,21-/m0/s1
InChIKey
WZRFLSDVFPIXOV-LRQRDZAKSA-N
Computed Properties
Structural Parameters
Heavy atom count
35
Aromatic heavy atom count
11
Fraction Csp3
0.56
Rotatable bonds
8
H-bond acceptors
7
H-bond donors
3
Molar refractivity
135.74
TPSA
116.32
LogP / Solubility
WLOGP
2.81
MLOGP
2.51
XLogP3
3.4
Consensus LogP
2.91
Log S (ESOL)
-4.41
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.68
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.19
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.77
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4.5
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