CAS RN: 1131595-36-2
3-methyl-1H-indazol-7-ol
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.20250725 | 250mg / 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS1131595-36-2
- Purity/Analytical Methods: >99.0%
1131595-36-2 / 3-methyl-2H-indazol-7-ol
3-methyl-1H-indazol-7-ol | 3-methyl-2H-indazol-7-ol | MFCD11109856
Basic Information
CAS
1131595-36-2
Multi CAS
No
Molecular Formula
C8H8N2O
Molecular Weight
148.160000
Exact Mass
148.063663
SMILES
CC1=C2C=CC=C(C2=NN1)O
InChI
InChI=1S/C8H8N2O/c1-5-6-3-2-4-7(11)8(6)10-9-5/h2-4,11H,1H3,(H,9,10)
InChIKey
BOPBKEWPSKGMSR-UHFFFAOYSA-N
Synonyms
3-methyl-1H-indazol-7-ol
3-methyl-2H-indazol-7-ol
MFCD11109856
SCHEMBL3635678
DTXSID30676378
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
9
Fraction Csp3
0.12
H-bond acceptors
2
H-bond donors
2
Molar refractivity
42.5
TPSA
48.91
LogP / Solubility
WLOGP
1.58
MLOGP
1.38
XLogP3
1.6
Consensus LogP
1.52
Log S (ESOL)
-2.36
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.91
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.93
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.5
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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- Product Code: starshine_CAS1131604-90-4
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