CAS RN: 37140-99-1

Methacrylamide, N-(p-hydroxyphenethyl)-

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260510 250mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS37140-99-1
  • Purity/Analytical Methods: >99.0%
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37140-99-1 / N-[2-(4-hydroxyphenyl)ethyl]-2-methylprop-2-enamide

Standard CAS: 37140-99-1 Multi CAS: Yes

Basic Information

CAS
37140-99-1
Multi CAS
Yes
Molecular Formula
C12H15NO2
Molecular Weight
205.250000
Exact Mass
205.110279
InChI
InChI=1S/C12H15NO2/c1-9(2)12(15)13-8-7-10-3-5-11(14)6-4-10/h3-6,14H,1,7-8H2,2H3,(H,13,15)
InChIKey
VGFIPNNZCAAAMJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
4
H-bond acceptors
2
H-bond donors
2
Molar refractivity
59.63
TPSA
49.33

LogP / Solubility

WLOGP
1.63
MLOGP
1.43
XLogP3
2.1
Consensus LogP
1.72
Log S (ESOL)
-2.17
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.42
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.82
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)
-2.82

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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