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CAS 1257227-64-7 Propanamide, N-(2-fluorophenyl)-2-hydroxy-N-methyl- molecular structure lightbox
CAS RN: 1257227-64-7

Propanamide, N-(2-fluorophenyl)-2-hydroxy-N-methyl-

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3 package records2 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260528 1g / 5g / 25g Confirm by inquiry Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260524 1g In stock Shanghai Inquiry
Batchno.20250712 5g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1257227-64-7
  • Purity/Analytical Methods: >99.0%
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1257227-64-7 / N-(2-fluorophenyl)-2-hydroxy-N-methylpropanamide

Standard CAS: 1257227-64-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1257227-64-7
Multi CAS
No
Molecular Formula
C10H12FNO2
Molecular Weight
197.210000
Exact Mass
197.085207
SMILES
CC(C(=O)N(C)C1=CC=CC=C1F)O
InChI
InChI=1S/C10H12FNO2/c1-7(13)10(14)12(2)9-6-4-3-5-8(9)11/h3-7,13H,1-2H3
InChIKey
QZCRGDGZEMJMDZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.3
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
51.49
TPSA
40.54

LogP / Solubility

WLOGP
1.17
MLOGP
1.03
XLogP3
1.1
Consensus LogP
1.1
Log S (ESOL)
-1.98
Class (ESOL)
Soluble
Log S (Ali)
-2.02
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.15
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)
-3.09

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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