CAS RN: 36320-82-8

Pyrimido[1,2-a]benzimidazol-4(1H)-one (9CI)

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Batchno.20250928 25mg / 100mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS36320-82-8
  • Purity/Analytical Methods: >99.0%
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36320-82-8 / 10H-pyrimido[1,2-a]benzimidazol-4-one

Standard CAS: 36320-82-8 Multi CAS: Yes

Basic Information

CAS
36320-82-8
Multi CAS
Yes
Molecular Formula
C10H7N3O
Molecular Weight
185.180000
Exact Mass
185.058912
InChI
InChI=1S/C10H7N3O/c14-9-5-6-11-10-12-7-3-1-2-4-8(7)13(9)10/h1-6H,(H,11,12)
InChIKey
CGZQZQJXCXOPDW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
13
H-bond acceptors
3
H-bond donors
1
Molar refractivity
53.32
TPSA
50.16

LogP / Solubility

WLOGP
1.18
MLOGP
1.03
XLogP3
0.5
Consensus LogP
0.9
Log S (ESOL)
-2.42
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.93
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.84
Class (SILICOS-IT)
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)
-3.01

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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