CAS RN: 831203-37-3

CYCLOPROPYL-FURAN-2-YLMETHYL-AMINE

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250413 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS831203-37-3
  • Purity/Analytical Methods: >99.0%
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831203-37-3 / N-(furan-2-ylmethyl)cyclopropanamine

Standard CAS: 831203-37-3 Multi CAS: No

Basic Information

CAS
831203-37-3
Multi CAS
No
Molecular Formula
C8H11NO
Molecular Weight
137.180000
Exact Mass
137.084064
InChI
InChI=1S/C8H11NO/c1-2-8(10-5-1)6-9-7-3-4-7/h1-2,5,7,9H,3-4,6H2
InChIKey
QDPDMHNZROESOW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
5
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
1
Molar refractivity
38.57
TPSA
25.17

LogP / Solubility

WLOGP
1.53
MLOGP
1.34
XLogP3
0.9
Consensus LogP
1.26
Log S (ESOL)
-1.83
Class (ESOL)
Soluble
Log S (Ali)
-1.79
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.18
Class (SILICOS-IT)
Moderately 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)
-2.47

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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