CAS RN: 618070-68-1
5-AMINO-1-(4-BROMOPHENYL)-1H-PYRAZOLE-4-CARBOHYDRAZIDE
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.20260317 | 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS618070-68-1
- Purity/Analytical Methods: >99.0%
618070-68-1 / 5-amino-1-(4-bromophenyl)pyrazole-4-carbohydrazide
Basic Information
CAS
618070-68-1
Multi CAS
Yes
Molecular Formula
BC10H10ORn5
Molecular Weight
296.120000
Exact Mass
295.006870
InChI
InChI=1S/C10H10BrN5O/c11-6-1-3-7(4-2-6)16-9(12)8(5-14-16)10(17)15-13/h1-5H,12-13H2,(H,15,17)
InChIKey
XKCCKDRUAISHDI-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
11
Rotatable bonds
2
H-bond acceptors
5
H-bond donors
3
Molar refractivity
67.33
TPSA
98.96
LogP / Solubility
WLOGP
0.82
MLOGP
0.73
XLogP3
1.3
Consensus LogP
0.95
Log S (ESOL)
-2.54
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.58
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.51
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)
-3.94
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
1.5
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