CAS RN: 37760-98-8
(S)-Methyl 2-aMino-2-phenylacetate
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250525 | 25mg / 100mg / 1g / 5g | Confirm by inquiry | Shanghai, Guangdong | Inquiry |
- Product code: starshine_CAS37760-98-8
- Purity/Analytical Methods: >99.0%
37760-98-8 / methyl 2-amino-2-phenylacetate
Basic Information
CAS
37760-98-8
Multi CAS
Yes
Molecular Formula
C9H11NO2
Molecular Weight
165.190000
Exact Mass
165.078979
InChI
InChI=1S/C9H11NO2/c1-12-9(11)8(10)7-5-3-2-4-6-7/h2-6,8H,10H2,1H3/t8-/m0/s1
InChIKey
BHFLUDRTVIDDOR-QMMMGPOBSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.22
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
45.39
TPSA
52.32
LogP / Solubility
WLOGP
0.86
MLOGP
0.75
XLogP3
0.9
Consensus LogP
0.84
Log S (ESOL)
-1.64
Class (ESOL)
Soluble
Log S (Ali)
-1.54
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.69
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)
-3.12
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
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