CAS 59074-26-9 3-(4-CHLOROPHENYL)-4-PHENYL-1H PYRAZOLE molecular structure

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CAS RN: 59074-26-9

3-(4-CHLOROPHENYL)-4-PHENYL-1H PYRAZOLE

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1 package records0 with current stock1 grade group

Grade In stock only

Batch No.	Package	Availability	Lead Time	Inquiry
Batchno.20260522	100mg / 250mg / 1g	Out of stock	5-7 business days	Inquiry

Product code: SSC-167457

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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 59074-26-9
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
1g	≥95%	0 Out of Stock	Shenzhen	Inquiry

59074-26-9 / 3-(4-chlorophenyl)-4-phenyl-4,5-dihydro-1H-pyrazole

Standard CAS: 59074-26-9 Multi CAS: Yes

Basic Information Computed Properties

Basic Information

CAS

59074-26-9

Multi CAS

Yes

Molecular Formula

C15H13CLN2

Molecular Weight

256.730000

Exact Mass

256.076726

InChI

InChI=1S/C15H13ClN2/c16-13-8-6-12(7-9-13)15-14(10-17-18-15)11-4-2-1-3-5-11/h1-9,14,17H,10H2

InChIKey

SKLKZKAMWPQZLM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count

Aromatic heavy atom count

Fraction Csp3

0.13

Rotatable bonds

H-bond acceptors

H-bond donors

Molar refractivity

75.17

TPSA

24.39

LogP / Solubility

WLOGP

3.43

MLOGP

3.03

XLogP3

4.1

Consensus LogP

3.52

Log S (ESOL)

-3.95

Class (ESOL)

Poorly soluble

Log S (Ali)

-4.14

Class (Ali)

Slightly soluble

Log S (SILICOS-IT)

-4.42

Class (SILICOS-IT)

Slightly soluble

ADME

GI absorption

High

BBB permeant

Yes

P-gp substrate

CYP1A2 inhibitor

Yes

CYP2C19 inhibitor

Yes

CYP2C9 inhibitor

CYP2D6 inhibitor

Yes

CYP3A4 inhibitor

Log Kp (skin permeation)

-1.85

Drug-likeness / Medicinal Chemistry

Lipinski

Yes

Ghose

Veber

Yes

Egan

Yes

Muegge

Yes

Bioavailability score

0.55

Leadlikeness

Yes

Synthetic Accessibility

3-(4-CHLOROPHENYL)-4-PHENYL-1H PYRAZOLE

Product Availability

Historical Supply Reference

Reference Pack Sizes

59074-26-9 / 3-(4-chlorophenyl)-4-phenyl-4,5-dihydro-1H-pyrazole

Basic Information

Computed Properties

Structural Parameters

LogP / Solubility

ADME

Drug-likeness / Medicinal Chemistry

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