[email protected]
CAS 1374509-48-4 2-(4-Fluoro-phenyl)-cyclopropanecarboxylic acid amide molecular structure lightbox
CAS RN: 1374509-48-4

2-(4-Fluoro-phenyl)-cyclopropanecarboxylic acid amide

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251105 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS1374509-48-4
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

1374509-48-4 / 2-(4-fluorophenyl)cyclopropane-1-carboxamide

Standard CAS: 1374509-48-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1374509-48-4
Multi CAS
No
Molecular Formula
C10H10FNO
Molecular Weight
179.190000
Exact Mass
179.074642
SMILES
C1C(C1C(=O)N)C2=CC=C(C=C2)F
InChI
InChI=1S/C10H10FNO/c11-7-3-1-6(2-4-7)8-5-9(8)10(12)13/h1-4,8-9H,5H2,(H2,12,13)
InChIKey
STWWQOVXTPFRIN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.3
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
46.44
TPSA
43.09

LogP / Solubility

WLOGP
1.41
MLOGP
1.24
XLogP3
1.1
Consensus LogP
1.25
Log S (ESOL)
-2.05
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.05
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.24
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)
-2.81

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

Customers Also Viewed

Get In Touch

Contact Us