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CAS 75230-50-1 N’-(1-(4-chlorophenyl)ethylidene)-4-methylbenzenesulfonohydrazide molecular structure lightbox
CAS RN: 75230-50-1

N’-(1-(4-chlorophenyl)ethylidene)-4-methylbenzenesulfonohydrazide

  • Product code: SSC-184713
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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 75230-50-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

75230-50-1 / N-[1-(4-chlorophenyl)ethylideneamino]-4-methylbenzenesulfonamide

Standard CAS: 75230-50-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
75230-50-1
Multi CAS
Yes
Molecular Formula
C15H15CLN2O2S
Molecular Weight
322.800000
Exact Mass
322.054277
InChI
InChI=1S/C15H15ClN2O2S/c1-11-3-9-15(10-4-11)21(19,20)18-17-12(2)13-5-7-14(16)8-6-13/h3-10,18H,1-2H3
InChIKey
LXTKFUSDWSCUJN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
21
Aromatic heavy atom count
12
Fraction Csp3
0.13
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
1
Molar refractivity
85.16
TPSA
58.53

LogP / Solubility

WLOGP
3.35
MLOGP
2.96
XLogP3
3.7
Consensus LogP
3.34
Log S (ESOL)
-4.11
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.63
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.02
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.31

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5

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