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CAS 35345-09-6 2-(4-CHLOROPHENYL)-4-METHYL-3H-IMIDAZOLE molecular structure lightbox
CAS RN: 35345-09-6

2-(4-CHLOROPHENYL)-4-METHYL-3H-IMIDAZOLE

  • Product code: SSC-142325
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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: 1g, 0.25g, 0.1g
  • Available purity: ≥95%
  • Inventory rows with stock: 2
  • 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 35345-09-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 3 In Stock Beijing Inquiry
0.25g ≥95% 1 In Stock Hong Kong Inquiry
0.1g ≥95% 0 Out of Stock Shanghai Inquiry

35345-09-6 / 2-(4-chlorophenyl)-5-methyl-1H-imidazole

Standard CAS: 35345-09-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
35345-09-6
Multi CAS
Yes
Molecular Formula
C10H9CLN2
Molecular Weight
192.640000
Exact Mass
192.045426
InChI
InChI=1S/C10H9ClN2/c1-7-6-12-10(13-7)8-2-4-9(11)5-3-8/h2-6H,1H3,(H,12,13)
InChIKey
PALVXRUKMAHOPW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
11
Fraction Csp3
0.1
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
53.77
TPSA
28.68

LogP / Solubility

WLOGP
3.04
MLOGP
2.67
XLogP3
2.8
Consensus LogP
2.84
Log S (ESOL)
-3.51
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.33
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.55
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.74

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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