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CAS 93957-49-4 3-(4-Fluorophenyl)-1-isopropylindole molecular structure lightbox
CAS RN: 93957-49-4

3-(4-Fluorophenyl)-1-isopropylindole

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250609 100g In stock Inquiry
Batchno.20250131 25g In stock Inquiry
Batchno.20251120 500g In stock Inquiry
Batchno.20250603 5g In stock Inquiry
  • Product code: SSC-208446
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 25g, 5g, 10g, 100g
  • Available purity: ≥98%
  • Inventory rows with stock: 1
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 93957-49-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥98% 4 In Stock Hong Kong Inquiry
5g ≥98% 0 Out of Stock Beijing Inquiry
10g ≥98% 0 Out of Stock Hong Kong Inquiry
100g ≥98% 0 Out of Stock Shanghai Inquiry

93957-49-4 / 3-(4-fluorophenyl)-1-propan-2-ylindole

Standard CAS: 93957-49-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
93957-49-4
Multi CAS
Yes
Molecular Formula
C17FH16N
Molecular Weight
253.310000
Exact Mass
253.126678
InChI
InChI=1S/C17H16FN/c1-12(2)19-11-16(13-7-9-14(18)10-8-13)15-5-3-4-6-17(15)19/h3-12H,1-2H3
InChIKey
ZDZJOIIBECYKAJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
15
Fraction Csp3
0.18
Rotatable bonds
2
H-bond acceptors
1
Molar refractivity
77.72
TPSA
4.93

LogP / Solubility

WLOGP
5.03
MLOGP
4.43
XLogP3
4.4
Consensus LogP
4.62
Log S (ESOL)
-5.03
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.27
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.72
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.7

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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