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CAS 282547-31-3 7-Benzofuranamine,5-fluoro-2,3-dihydro-(9CI) molecular structure lightbox
CAS RN: 282547-31-3

7-Benzofuranamine,5-fluoro-2,3-dihydro-(9CI)

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260420 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS282547-31-3
  • Purity/Analytical Methods: >99.0%
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282547-31-3 / 5-fluoro-2,3-dihydro-1-benzofuran-7-amine

Standard CAS: 282547-31-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
282547-31-3
Multi CAS
No
Molecular Formula
C8FH8NO
Molecular Weight
153.150000
Exact Mass
153.058992
InChI
InChI=1S/C8H8FNO/c9-6-3-5-1-2-11-8(5)7(10)4-6/h3-4H,1-2,10H2
InChIKey
RVNVPUIBRNFOTP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.25
H-bond acceptors
2
H-bond donors
1
Molar refractivity
40.01
TPSA
35.25

LogP / Solubility

WLOGP
1.34
MLOGP
1.18
XLogP3
1.3
Consensus LogP
1.27
Log S (ESOL)
-2.04
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.79
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.77
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)
-2.7

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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