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CAS 1228570-77-1 (3S)-7-FLUORO-2,3-DIHYDRO-1-BENZOFURAN-3-AMINE molecular structure lightbox
CAS RN: 1228570-77-1

(3S)-7-FLUORO-2,3-DIHYDRO-1-BENZOFURAN-3-AMINE

Product Availability

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3 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250227 100mg Out of stock Inquiry
Batchno.20250903 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
Batchno.20250327 250mg Out of stock Inquiry
  • Product code: SSC-026462
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1228570-77-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shenzhen Inquiry

1228570-77-1 / (3S)-7-fluoro-2,3-dihydro-1-benzofuran-3-amine

Standard CAS: 1228570-77-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1228570-77-1
Multi CAS
No
Molecular Formula
C8H8FNO
Molecular Weight
153.150000
Exact Mass
153.058992
SMILES
C1[C@H](C2=C(O1)C(=CC=C2)F)N
InChI
InChI=1S/C8H8FNO/c9-6-3-1-2-5-7(10)4-11-8(5)6/h1-3,7H,4,10H2/t7-/m1/s1
InChIKey
RMYMQTQTLUJTIX-SSDOTTSWSA-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
38.82
TPSA
35.25

LogP / Solubility

WLOGP
1.22
MLOGP
1.07
XLogP3
0.7
Consensus LogP
1
Log S (ESOL)
-1.96
Class (ESOL)
Soluble
Log S (Ali)
-1.7
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.67
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)
-2.79

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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