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CAS 256922-53-9 2-Propylthiazolo[4,5-c]quinolin-4-aMine molecular structure lightbox
CAS RN: 256922-53-9

2-Propylthiazolo[4,5-c]quinolin-4-aMine

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7 package records7 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250418 100mg In stock Shanghai Inquiry
Batchno.20250515 10mg In stock Shanghai Inquiry
Batchno.20250322 1mg In stock Shanghai Inquiry
Batchno.20250621 250mg In stock Shanghai Inquiry
Batchno.20250826 25mg In stock Shanghai Inquiry
Batchno.20250730 50mg In stock Shanghai Inquiry
Batchno.20250213 5mg In stock Shanghai Inquiry
  • Product code: starshine_CAS256922-53-9
  • Purity/Analytical Methods: >99.0%
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256922-53-9 / 2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine

Standard CAS: 256922-53-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
256922-53-9
Multi CAS
No
Molecular Formula
C13H13N3S
Molecular Weight
243.330000
Exact Mass
243.083019
SMILES
CCCC1=NC2=C(S1)C3=CC=CC=C3N=C2N
InChI
InChI=1S/C13H13N3S/c1-2-5-10-16-11-12(17-10)8-6-3-4-7-9(8)15-13(11)14/h3-4,6-7H,2,5H2,1H3,(H2,14,15)
InChIKey
NFYMGJSUKCDVJR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
13
Fraction Csp3
0.23
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
73.33
TPSA
51.8

LogP / Solubility

WLOGP
3.38
MLOGP
2.98
XLogP3
3.5
Consensus LogP
3.29
Log S (ESOL)
-3.91
Class (ESOL)
Poorly soluble
Log S (Ali)
-4
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.29
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.81

Drug-likeness / Medicinal Chemistry

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

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