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CAS 59174-12-8 N’-HYDROXY-2-(2-THIENYL)ETHANIMIDAMIDE molecular structure lightbox
CAS RN: 59174-12-8

N’-HYDROXY-2-(2-THIENYL)ETHANIMIDAMIDE

  • Product code: SSC-167573
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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 59174-12-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

59174-12-8 / N'-hydroxy-2-thiophen-2-ylethanimidamide

Standard CAS: 59174-12-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
59174-12-8
Multi CAS
Yes
Molecular Formula
C6H8N2OS
Molecular Weight
156.210000
Exact Mass
156.035734
InChI
InChI=1S/C6H8N2OS/c7-6(8-9)4-5-2-1-3-10-5/h1-3,9H,4H2,(H2,7,8)
InChIKey
LHSWRTYGIVUVHO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
5
Fraction Csp3
0.17
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
41.43
TPSA
58.61

LogP / Solubility

WLOGP
1.04
MLOGP
0.91
XLogP3
0.6
Consensus LogP
0.85
Log S (ESOL)
-1.7
Class (ESOL)
Soluble
Log S (Ali)
-1.59
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.78
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.94

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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