CAS RN: 946402-24-0

2-(2,6-Difluorophenyl)-N-Methoxy-N-Methylacetamide

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Batchno.20250503 100mg / 250mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS946402-24-0
  • Purity/Analytical Methods: >99.0%
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946402-24-0 / 2-(2,6-difluorophenyl)-N-methoxy-N-methylacetamide

Standard CAS: 946402-24-0 Multi CAS: No

Basic Information

CAS
946402-24-0
Multi CAS
No
Molecular Formula
C10F2H11NO2
Molecular Weight
215.200000
Exact Mass
215.075785
InChI
InChI=1S/C10H11F2NO2/c1-13(15-2)10(14)6-7-8(11)4-3-5-9(7)12/h3-5H,6H2,1-2H3
InChIKey
WTZYIIJRZRGMGO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.3
Rotatable bonds
3
H-bond acceptors
2
Molar refractivity
49.84
TPSA
29.54

LogP / Solubility

WLOGP
1.53
MLOGP
1.35
XLogP3
1.6
Consensus LogP
1.49
Log S (ESOL)
-2.23
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.43
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.69
Class (SILICOS-IT)
Moderately 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)
-2.95

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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