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CAS 1780955-90-9 6-Methoxy-imidazo[1,2-a]pyridine-2-carbaldehyde molecular structure lightbox
CAS RN: 1780955-90-9

6-Methoxy-imidazo[1,2-a]pyridine-2-carbaldehyde

  • Product code: SSC-078253
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g
  • Available purity: >95%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1780955-90-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 1 In Stock Beijing Inquiry
0.25g >95% 1 In Stock Hong Kong Inquiry
1g >95% 1 In Stock Shenzhen Inquiry

1780955-90-9 / 6-methoxyimidazo[1,2-a]pyridine-2-carbaldehyde

Standard CAS: 1780955-90-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1780955-90-9
Multi CAS
No
Molecular Formula
C9H8N2O2
Molecular Weight
176.170000
Exact Mass
176.058578
SMILES
COC1=CN2C=C(N=C2C=C1)C=O
InChI
InChI=1S/C9H8N2O2/c1-13-8-2-3-9-10-7(6-12)4-11(9)5-8/h2-6H,1H3
InChIKey
QZPJPUASHGYBQX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
9
Fraction Csp3
0.11
Rotatable bonds
2
H-bond acceptors
4
Molar refractivity
47.13
TPSA
43.6

LogP / Solubility

WLOGP
1.16
MLOGP
1.01
XLogP3
1.5
Consensus LogP
1.22
Log S (ESOL)
-2.04
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.84
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2
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)
-2.97

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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