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CAS 244022-74-0 2-[3,5-bis(Trifluoromethyl)phenyl]-N’-hydroxyethanimidamide molecular structure lightbox
CAS RN: 244022-74-0

2-[3,5-bis(Trifluoromethyl)phenyl]-N’-hydroxyethanimidamide

  • Product code: SSC-118796
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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 244022-74-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

244022-74-0 / 2-[3,5-bis(trifluoromethyl)phenyl]-N'-hydroxyethanimidamide

Standard CAS: 244022-74-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
244022-74-0
Multi CAS
Yes
Molecular Formula
C10H8F6N2O
Molecular Weight
286.170000
Exact Mass
286.054082
InChI
InChI=1S/C10H8F6N2O/c11-9(12,13)6-1-5(3-8(17)18-19)2-7(4-6)10(14,15)16/h1-2,4,19H,3H2,(H2,17,18)
InChIKey
UFYSBKCOGRNGQA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
6
Fraction Csp3
0.3
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
53.56
TPSA
58.61

LogP / Solubility

WLOGP
3.01
MLOGP
2.66
XLogP3
2.8
Consensus LogP
2.82
Log S (ESOL)
-3.61
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.08
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.26
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.33

Drug-likeness / Medicinal Chemistry

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

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