CAS RN: 393121-74-9
N-(2-hydroxy-5-methylphenyl)-3-phenylpropanamide
Product Availability
Choose a grade to view its available package options.
5 package records5 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250109 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20250907 | 1g | In stock | Shanghai, Shenzhen | Inquiry |
| Batchno.20250521 | 250mg | In stock | Shanghai, Shenzhen | Inquiry |
| Batchno.20260223 | 50mg | In stock | Shanghai, Shenzhen | Inquiry |
| Batchno.20250220 | 5g | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS393121-74-9
- Purity/Analytical Methods: >99.0%
393121-74-9 / N-(2-hydroxy-5-methylphenyl)-3-phenylpropanamide
Basic Information
CAS
393121-74-9
Multi CAS
No
Molecular Formula
C16H17NO2
Molecular Weight
255.310000
Exact Mass
255.125929
InChI
InChI=1S/C16H17NO2/c1-12-7-9-15(18)14(11-12)17-16(19)10-8-13-5-3-2-4-6-13/h2-7,9,11,18H,8,10H2,1H3,(H,17,19)
InChIKey
AWHLTHOHBAGPMY-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
19
Aromatic heavy atom count
12
Fraction Csp3
0.19
Rotatable bonds
4
H-bond acceptors
2
H-bond donors
2
Molar refractivity
76.24
TPSA
49.33
LogP / Solubility
WLOGP
3.27
MLOGP
2.89
XLogP3
3.3
Consensus LogP
3.15
Log S (ESOL)
-3.69
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.02
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.52
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.95
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5
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