![CAS 52485-51-5 Acetamide, N-[(1S)-1-(hydroxymethyl)-2-phenylethyl]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/52485-51-5.gif)
CAS RN: 52485-51-5
Acetamide, N-[(1S)-1-(hydroxymethyl)-2-phenylethyl]-
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260509 | 250mg / 1g / 5g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS52485-51-5
- Purity/Analytical Methods: >99.0%
52485-51-5 / N-(1-hydroxy-3-phenylpropan-2-yl)acetamide
Basic Information
CAS
52485-51-5
Multi CAS
Yes
Molecular Formula
C11H15NO2
Molecular Weight
193.240000
Exact Mass
193.110279
InChI
InChI=1S/C11H15NO2/c1-9(14)12-11(8-13)7-10-5-3-2-4-6-10/h2-6,11,13H,7-8H2,1H3,(H,12,14)/t11-/m0/s1
InChIKey
OKDZNDUPIRUYLF-NSHDSACASA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.36
Rotatable bonds
4
H-bond acceptors
2
H-bond donors
2
Molar refractivity
54.84
TPSA
49.33
LogP / Solubility
WLOGP
0.73
MLOGP
0.64
XLogP3
0.9
Consensus LogP
0.76
Log S (ESOL)
-1.55
Class (ESOL)
Soluble
Log S (Ali)
-1.67
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2
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)
-3.38
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
Customers Also Viewed
-
-
-
Dichloro(p-cyMene)triphenylphosphinerutheniuM(II) dichloroMethane adduct, Min. 98%
- CAS RN: 52490-94-5
- Product Code: SSC-159609
-
-
-
(5-P-TOLYLAMINO-[1,3,4]THIADIAZOL-2-YLSULFANYL)-ACETIC ACID HYDRAZIDE
- CAS RN: 52494-24-3
- Product Code: SSC-159615
![CAS 52494-24-3 (5-P-TOLYLAMINO-[1,3,4]THIADIAZOL-2-YLSULFANYL)-ACETIC ACID HYDRAZIDE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/52494-24-3.gif)