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CAS 33866-44-3 3-(2-FURYL)ISOXAZOL-5-AMINE molecular structure lightbox
CAS RN: 33866-44-3

3-(2-FURYL)ISOXAZOL-5-AMINE

Product Availability

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4 package records1 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20260628 10mg In stock Inquiry
Batchno.20250802 1g Out of stock Inquiry
Batchno.20260118 250mg Out of stock Inquiry
Batchno.20260619 50mg Out of stock Inquiry
  • Product code: starshine_CAS33866-44-3
  • Purity/Analytical Methods: >99.0%
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33866-44-3 / 3-(furan-2-yl)-1,2-oxazol-5-amine

Standard CAS: 33866-44-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
33866-44-3
Multi CAS
No
Molecular Formula
C7H6N2O2
Molecular Weight
150.130000
Exact Mass
150.042927
InChI
InChI=1S/C7H6N2O2/c8-7-4-5(9-11-7)6-2-1-3-10-6/h1-4H,8H2
InChIKey
MKXZGFIJQYOAAA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
10
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
38.62
TPSA
65.19

LogP / Solubility

WLOGP
1.52
MLOGP
1.33
XLogP3
0.8
Consensus LogP
1.22
Log S (ESOL)
-2.33
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.89
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.01
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)
-2.56

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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