CAS RN: 324016-20-8

2-HYDRAZINO-2-OXO-N-[3-(TRIFLUOROMETHYL)PHENYL]ACETAMIDE

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250114 5mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS324016-20-8
  • Purity/Analytical Methods: >99.0%
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324016-20-8 / 2-hydrazinyl-2-oxo-N-[3-(trifluoromethyl)phenyl]acetamide

Standard CAS: 324016-20-8 Multi CAS: Yes

Basic Information

CAS
324016-20-8
Multi CAS
Yes
Molecular Formula
C9F3H8N3O2
Molecular Weight
247.170000
Exact Mass
247.056861
InChI
InChI=1S/C9H8F3N3O2/c10-9(11,12)5-2-1-3-6(4-5)14-7(16)8(17)15-13/h1-4H,13H2,(H,14,16)(H,15,17)
InChIKey
SYUAHTBYNDCTOK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.11
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
3
Molar refractivity
52.4
TPSA
84.22

LogP / Solubility

WLOGP
0.63
MLOGP
0.56
XLogP3
2.1
Consensus LogP
1.1
Log S (ESOL)
-1.97
Class (ESOL)
Soluble
Log S (Ali)
-2.04
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-1.91
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.78

Drug-likeness / Medicinal Chemistry

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

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