CAS RN: 183427-87-4

2-(2-METHOXYPHENOXY)ACETAMIDE

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260103 1g / 5g / 25g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS183427-87-4
  • Purity/Analytical Methods: >99.0%
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183427-87-4 / 2-(2-methoxyphenoxy)acetamide

Standard CAS: 183427-87-4 Multi CAS: No

Basic Information

CAS
183427-87-4
Multi CAS
No
Molecular Formula
C9H11NO3
Molecular Weight
181.190000
Exact Mass
181.073893
SMILES
COC1=CC=CC=C1OCC(=O)N
InChI
InChI=1S/C9H11NO3/c1-12-7-4-2-3-5-8(7)13-6-9(10)11/h2-5H,6H2,1H3,(H2,10,11)
InChIKey
SWSQFEAWQBOBAI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.22
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
1
Molar refractivity
47.68
TPSA
61.55

LogP / Solubility

WLOGP
0.56
MLOGP
0.49
XLogP3
0.3
Consensus LogP
0.45
Log S (ESOL)
-1.39
Class (ESOL)
Soluble
Log S (Ali)
-1.45
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.78
Class (SILICOS-IT)
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)
-3.43

Drug-likeness / Medicinal Chemistry

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

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