CAS RN: 956697-53-3
NVP-LDE225
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.20251213 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20260510 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250603 | 1g | In stock | Shanghai, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20250627 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20260111 | 250mg | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20260130 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20250417 | 5g | In stock | Shanghai, Shenzhen, Tianjin | Inquiry |
| Batchno.20250419 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS956697-53-3
- Purity/Analytical Methods: >99.0%
956697-53-3 / N-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]-2-methyl-3-[4-(trifluoromethoxy)phenyl]benzamide
Basic Information
CAS
956697-53-3
Multi CAS
Yes
Molecular Formula
C26F3H26N3O3
Molecular Weight
485.500000
Exact Mass
485.192626
InChI
InChI=1S/C26H26F3N3O3/c1-16-14-32(15-17(2)34-16)24-12-9-20(13-30-24)31-25(33)23-6-4-5-22(18(23)3)19-7-10-21(11-8-19)35-26(27,28)29/h4-13,16-17H,14-15H2,1-3H3,(H,31,33)/t16-,17+
InChIKey
VZZJRYRQSPEMTK-CALCHBBNSA-N
Computed Properties
Structural Parameters
Heavy atom count
35
Aromatic heavy atom count
18
Fraction Csp3
0.31
Rotatable bonds
5
H-bond acceptors
5
H-bond donors
1
Molar refractivity
127.71
TPSA
63.69
LogP / Solubility
WLOGP
5.82
MLOGP
5.16
XLogP3
5.8
Consensus LogP
5.59
Log S (ESOL)
-6.57
Class (ESOL)
Insoluble
Log S (Ali)
-7.74
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.25
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
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)
-1.55
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4
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