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CAS 197153-87-0 4-(1,2,2-triphenyl vinyl)benzoic acid molecular structure lightbox
CAS RN: 197153-87-0

4-(1,2,2-triphenyl vinyl)benzoic acid

Product Availability

Choose a grade to view its available package options.

5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251122 100g In stock Shanghai Inquiry
Batchno.20251127 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250625 250mg In stock Shanghai Inquiry
Batchno.20260602 25g In stock Shanghai, Chengdu Inquiry
Batchno.20250211 5g In stock Shanghai, Shenzhen, Tianjin Inquiry
  • Product code: SSC-092990
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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: 0.25g, 1g, 5g, 10g
  • Available purity: ≥97%
  • 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 197153-87-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥97% 1 In Stock Shenzhen Inquiry
1g ≥97% 0 Out of Stock Beijing Inquiry
5g ≥97% 0 Out of Stock Shanghai Inquiry
10g ≥97% 0 Out of Stock Hong Kong Inquiry

197153-87-0 / 4-(1,2,2-triphenylethenyl)benzoic acid

Standard CAS: 197153-87-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
197153-87-0
Multi CAS
No
Molecular Formula
C27H20O2
Molecular Weight
376.400000
Exact Mass
376.146330
SMILES
C1=CC=C(C=C1)C(=C(C2=CC=CC=C2)C3=CC=C(C=C3)C(=O)O)C4=CC=CC=C4
InChI
InChI=1S/C27H20O2/c28-27(29)24-18-16-23(17-19-24)26(22-14-8-3-9-15-22)25(20-10-4-1-5-11-20)21-12-6-2-7-13-21/h1-19H,(H,28,29)
InChIKey
BYQULXPMSUDNFL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
29
Aromatic heavy atom count
24
Rotatable bonds
5
H-bond acceptors
1
H-bond donors
1
Molar refractivity
117.75
TPSA
37.3

LogP / Solubility

WLOGP
6.39
MLOGP
5.65
XLogP3
7.5
Consensus LogP
6.51
Log S (ESOL)
-6.48
Class (ESOL)
Insoluble
Log S (Ali)
-7.26
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.01
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.48

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

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