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CAS 774178-09-5 1H-Imidazo[4,5-c]pyridine, 4,5,6,7-tetrahydro-2-methyl- (9CI) molecular structure lightbox
CAS RN: 774178-09-5

1H-Imidazo[4,5-c]pyridine, 4,5,6,7-tetrahydro-2-methyl- (9CI)

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250331 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS774178-09-5
  • Purity/Analytical Methods: >99.0%
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774178-09-5 / 2-methyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine

Standard CAS: 774178-09-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
774178-09-5
Multi CAS
Yes
Molecular Formula
C7H11N3
Molecular Weight
137.180000
Exact Mass
137.095297
InChI
InChI=1S/C7H11N3/c1-5-9-6-2-3-8-4-7(6)10-5/h8H,2-4H2,1H3,(H,9,10)
InChIKey
CVDDYBUFDUAOJL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
5
Fraction Csp3
0.57
H-bond acceptors
2
H-bond donors
2
Molar refractivity
38.74
TPSA
40.71

LogP / Solubility

WLOGP
0.36
MLOGP
0.31
XLogP3
-0.1
Consensus LogP
0.19
Log S (ESOL)
-1.29
Class (ESOL)
Soluble
Log S (Ali)
-0.95
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.85
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)
-3.3

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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