CAS RN: 142706-18-1
(+)-(R)-Pantoprazole
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20251006 | 5mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS142706-18-1
- Purity/Analytical Methods: >99.0%
142706-18-1 / 6-(difluoromethoxy)-2-[(R)-(3,4-dimethoxy-2-pyridinyl)methylsulfinyl]-1H-benzimidazole
Basic Information
CAS
142706-18-1
Multi CAS
No
Molecular Formula
C16H15F2N3O4S
Molecular Weight
383.400000
Exact Mass
383.075133
SMILES
COC1=C(C(=NC=C1)C[S@@](=O)C2=NC3=C(N2)C=C(C=C3)OC(F)F)OC
InChI
InChI=1S/C16H15F2N3O4S/c1-23-13-5-6-19-12(14(13)24-2)8-26(22)16-20-10-4-3-9(25-15(17)18)7-11(10)21-16/h3-7,15H,8H2,1-2H3,(H,20,21)/t26-/m1/s1
InChIKey
IQPSEEYGBUAQFF-AREMUKBSSA-N
Computed Properties
Structural Parameters
Heavy atom count
26
Aromatic heavy atom count
15
Fraction Csp3
0.25
Rotatable bonds
7
H-bond acceptors
6
H-bond donors
1
Molar refractivity
90.18
TPSA
86.33
LogP / Solubility
WLOGP
2.88
MLOGP
2.56
XLogP3
2.4
Consensus LogP
2.61
Log S (ESOL)
-4
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.79
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.39
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.01
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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