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CAS 1373223-06-3 (7-Methoxy-1-methyl-1H-indazol-5-yl)-methanol molecular structure lightbox
CAS RN: 1373223-06-3

(7-Methoxy-1-methyl-1H-indazol-5-yl)-methanol

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260521 250mg / 1g / 5g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS1373223-06-3
  • Purity/Analytical Methods: >99.0%
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1373223-06-3 / (7-methoxy-1-methylindazol-5-yl)methanol

Standard CAS: 1373223-06-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1373223-06-3
Multi CAS
No
Molecular Formula
C10H12N2O2
Molecular Weight
192.210000
Exact Mass
192.089878
SMILES
CN1C2=C(C=C(C=C2OC)CO)C=N1
InChI
InChI=1S/C10H12N2O2/c1-12-10-8(5-11-12)3-7(6-13)4-9(10)14-2/h3-5,13H,6H2,1-2H3
InChIKey
XOHMIYCYXMDEIZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
9
Fraction Csp3
0.3
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
53.19
TPSA
47.28

LogP / Solubility

WLOGP
1.07
MLOGP
0.94
XLogP3
0.7
Consensus LogP
0.9
Log S (ESOL)
-2.05
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.91
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.04
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.13

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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