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CAS 1036991-50-0 1-(imidazo[1,2-a]pyridin-7-yl)ethanone molecular structure lightbox
CAS RN: 1036991-50-0

1-(imidazo[1,2-a]pyridin-7-yl)ethanone

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250802 100mg / 500mg Out of stock 5-7 business days Inquiry
  • Product code: SSC-005291
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1036991-50-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

1036991-50-0 / 1-imidazo[1,2-a]pyridin-7-ylethanone

1-(imidazo[1,2-a]pyridin-7-yl)ethanone | MFCD20527734 | 1-imidazo[1,2-a]pyridin-7-ylethanone

Standard CAS: 1036991-50-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1036991-50-0
Multi CAS
No
Molecular Formula
C9H8N2O
Molecular Weight
160.170000
Exact Mass
160.063663
SMILES
CC(=O)C1=CC2=NC=CN2C=C1
InChI
InChI=1S/C9H8N2O/c1-7(12)8-2-4-11-5-3-10-9(11)6-8/h2-6H,1H3
InChIKey
NUOQSUYSPVAFNO-UHFFFAOYSA-N
Synonyms
1-(imidazo[1,2-a]pyridin-7-yl)ethanone MFCD20527734 1-imidazo[1,2-a]pyridin-7-ylethanone SCHEMBL10138744 XH1381

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
9
Fraction Csp3
0.11
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
45.2
TPSA
34.37

LogP / Solubility

WLOGP
1.54
MLOGP
1.35
XLogP3
1.4
Consensus LogP
1.43
Log S (ESOL)
-2.29
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.98
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.1
Class (SILICOS-IT)
Moderately 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)
-2.61

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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