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CAS 1153757-71-1 Imidazo[1,2-a]pyrimidin-2-ylmethanol molecular structure lightbox
CAS RN: 1153757-71-1

Imidazo[1,2-a]pyrimidin-2-ylmethanol

  • Product code: SSC-015126
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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: 0.25g
  • 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 1153757-71-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shenzhen Inquiry

1153757-71-1 / imidazo[1,2-a]pyrimidin-2-ylmethanol

Imidazo[1,2-a]pyrimidin-2-ylmethanol | Imidazo[1,2-a]pyrimidine-2-methanol | {imidazo[1,2-a]pyrimidin-2-yl}methanol

Standard CAS: 1153757-71-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1153757-71-1
Multi CAS
No
Molecular Formula
C7H7N3O
Molecular Weight
149.150000
Exact Mass
149.058912
SMILES
C1=CN2C=C(N=C2N=C1)CO
InChI
InChI=1S/C7H7N3O/c11-5-6-4-10-3-1-2-8-7(10)9-6/h1-4,11H,5H2
InChIKey
XNVSCROCXIXWFK-UHFFFAOYSA-N
Synonyms
Imidazo[1,2-a]pyrimidin-2-ylmethanol Imidazo[1,2-a]pyrimidine-2-methanol {imidazo[1,2-a]pyrimidin-2-yl}methanol (Imidazo[1,2-a]pyrimidin-2-yl)methanol SCHEMBL9569958

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
Fraction Csp3
0.14
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
38.91
TPSA
50.42

LogP / Solubility

WLOGP
0.22
MLOGP
0.19
XLogP3
0.3
Consensus LogP
0.24
Log S (ESOL)
-1.44
Class (ESOL)
Soluble
Log S (Ali)
-0.94
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.93
Class (SILICOS-IT)
Very 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)
-3.47

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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