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CAS 34974-19-1 Benzene, 1-(chlorodiphenylmethyl)-4-phenoxy- molecular structure lightbox
CAS RN: 34974-19-1

Benzene, 1-(chlorodiphenylmethyl)-4-phenoxy-

  • Product code: SSC-141685
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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: 5g
  • 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 34974-19-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shanghai Inquiry

34974-19-1 / 1-[chloro(diphenyl)methyl]-4-phenoxybenzene

Standard CAS: 34974-19-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
34974-19-1
Multi CAS
No
Molecular Formula
C25H19CLO
Molecular Weight
370.900000
Exact Mass
370.112443
InChI
InChI=1S/C25H19ClO/c26-25(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-16-18-24(19-17-22)27-23-14-8-3-9-15-23/h1-19H
InChIKey
GTNNMWIWYKCUNC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
27
Aromatic heavy atom count
24
Fraction Csp3
0.04
Rotatable bonds
5
H-bond acceptors
1
Molar refractivity
111.58
TPSA
9.23

LogP / Solubility

WLOGP
7.01
MLOGP
6.19
XLogP3
7
Consensus LogP
6.73
Log S (ESOL)
-6.88
Class (ESOL)
Insoluble
Log S (Ali)
-7.66
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.49
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)
-0.01

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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