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CAS 70132-50-2 Pimonidazole, ≥98%(HPLC) molecular structure lightbox
CAS RN: 70132-50-2

Pimonidazole, ≥98%(HPLC)

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250703 5mg / 25mg / 100mg / 250mg / 1g Confirm by inquiry Shanghai 5-7 business days Inquiry
  • Product code: LINP920750
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70132-50-2 / 1-(2-nitroimidazol-1-yl)-3-piperidin-1-ylpropan-2-ol

Standard CAS: 70132-50-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
70132-50-2
Multi CAS
No
Molecular Formula
C11H18N4O3
Molecular Weight
254.290000
Exact Mass
254.137890
InChI
InChI=1S/C11H18N4O3/c16-10(8-13-5-2-1-3-6-13)9-14-7-4-12-11(14)15(17)18/h4,7,10,16H,1-3,5-6,8-9H2
InChIKey
WVWOOAYQYLJEFD-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
5
Fraction Csp3
0.73
Rotatable bonds
5
H-bond acceptors
6
H-bond donors
1
Molar refractivity
65.18
TPSA
84.43

LogP / Solubility

WLOGP
0.64
MLOGP
0.57
XLogP3
1
Consensus LogP
0.74
Log S (ESOL)
-1.69
Class (ESOL)
Soluble
Log S (Ali)
-2.11
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.44
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.82

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2

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