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CAS 5341-14-0 TRIS(4-BIPHENYL)-METHANOL molecular structure lightbox
CAS RN: 5341-14-0

TRIS(4-BIPHENYL)-METHANOL

  • Product code: SSC-160748
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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: ≥95%
  • 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 5341-14-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

5341-14-0 / tris(4-phenylphenyl)methanol

Standard CAS: 5341-14-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
5341-14-0
Multi CAS
Yes
Molecular Formula
C37H28O
Molecular Weight
488.600000
Exact Mass
488.214016
InChI
InChI=1S/C37H28O/c38-37(34-22-16-31(17-23-34)28-10-4-1-5-11-28,35-24-18-32(19-25-35)29-12-6-2-7-13-29)36-26-20-33(21-27-36)30-14-8-3-9-15-30/h1-27,38H
InChIKey
FURWFDHTIUIMDC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
38
Aromatic heavy atom count
36
Fraction Csp3
0.03
Rotatable bonds
6
H-bond acceptors
1
H-bond donors
1
Molar refractivity
157.73
TPSA
20.23

LogP / Solubility

WLOGP
8.97
MLOGP
7.93
XLogP3
8.6
Consensus LogP
8.5
Log S (ESOL)
-8.83
Class (ESOL)
Insoluble
Log S (Ali)
-10.04
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-11
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)
0.67

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
5.5

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