CAS RN: 2742962-60-1
(R)-N-benzyl-3-methoxy-2-(N-methylacetamido)propanamide
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.20260217 | 25mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS2742962-60-1
- Purity/Analytical Methods: >99.0%
2742962-60-1 / (2R)-2-[acetyl(methyl)amino]-N-benzyl-3-methoxypropanamide
Basic Information
CAS
2742962-60-1
Multi CAS
No
Molecular Formula
C14H20N2O3
Molecular Weight
264.320000
Exact Mass
264.147393
SMILES
CC(=O)N(C)[C@H](COC)C(=O)NCC1=CC=CC=C1
InChI
InChI=1S/C14H20N2O3/c1-11(17)16(2)13(10-19-3)14(18)15-9-12-7-5-4-6-8-12/h4-8,13H,9-10H2,1-3H3,(H,15,18)/t13-/m1/s1
InChIKey
IQPXOLXLQGVFDT-CYBMUJFWSA-N
Computed Properties
Structural Parameters
Heavy atom count
19
Aromatic heavy atom count
6
Fraction Csp3
0.43
Rotatable bonds
6
H-bond acceptors
3
H-bond donors
1
Molar refractivity
72.4
TPSA
58.64
LogP / Solubility
WLOGP
0.8
MLOGP
0.71
XLogP3
0.5
Consensus LogP
0.67
Log S (ESOL)
-1.82
Class (ESOL)
Soluble
Log S (Ali)
-2.3
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.76
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)
-3.77
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2
Customers Also Viewed
-
-
3-Azabicyclo[3.2.0]heptane-1-carboxylic acid, 3-(phenylmethyl)-, methyl ester, (1R,5R)-rel-
- CAS RN: 2751265-32-2
- Product Code: starshine_CAS2751265-32-2
- Purity/Analytical method: >99.0%
-
-
2,5-Cyclohexadiene-1,4-dione, 2-[(1,3-dimethylbutyl)amino]-5-(phenylamino)-
- CAS RN: 2754428-18-5
- Product Code: SSC-127069
-
(1R,2S,5S)-3-((S)-3,3-dimethyl-2-(2,2,2-trifluoroacetamido)butanoyl)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxylic acid
- CAS RN: 2755812-45-2
- Product Code: SSC-127108
-
(S)-2-amino-3-((S)-2-oxopyrrolidin-3-yl)propanenitrile hydrochloride
- CAS RN: 2755950-35-5
- Product Code: SSC-127129
![CAS 2751265-32-2 3-Azabicyclo[3.2.0]heptane-1-carboxylic acid, 3-(phenylmethyl)-, methyl ester, (1R,5R)-rel- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2751265-32-2.gif)
![CAS 2754428-18-5 2,5-Cyclohexadiene-1,4-dione, 2-[(1,3-dimethylbutyl)amino]-5-(phenylamino)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2754428-18-5.gif)
![CAS 2755812-45-2 (1R,2S,5S)-3-((S)-3,3-dimethyl-2-(2,2,2-trifluoroacetamido)butanoyl)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxylic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2755812-45-2.gif)
