CAS RN: 84771-33-5
2-Aziridinecarboxylic acid, 1-(triphenylmethyl)-, (2S)-
Product Availability
Choose a grade to view its available package options.
7 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251007 | 100mg | Out of stock | Inquiry | |
| Batchno.20250819 | 100mg / 250mg / 1g | Confirm by inquiry | Shandong | Inquiry |
| Batchno.20250722 | 10g | Out of stock | Inquiry | |
| Batchno.20250109 | 1g | Out of stock | Inquiry | |
| Batchno.20250719 | 250mg | Out of stock | Inquiry | |
| Batchno.20260304 | 25g | Out of stock | Inquiry | |
| Batchno.20260311 | 5g | Out of stock | Inquiry |
- Product code: starshine_CAS84771-33-5
- Purity/Analytical Methods: >99.0%
84771-33-5 / 1-tritylaziridine-2-carboxylic acid
Basic Information
CAS
84771-33-5
Multi CAS
Yes
Molecular Formula
C22H19NO2
Molecular Weight
329.400000
Exact Mass
329.141579
InChI
InChI=1S/C22H19NO2/c24-21(25)20-16-23(20)22(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15,20H,16H2,(H,24,25)
InChIKey
BXSIPZGNIBVSLK-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
25
Aromatic heavy atom count
18
Fraction Csp3
0.14
Rotatable bonds
5
H-bond acceptors
2
H-bond donors
1
Molar refractivity
97.34
TPSA
40.31
LogP / Solubility
WLOGP
3.75
MLOGP
3.31
XLogP3
2.1
Consensus LogP
3.05
Log S (ESOL)
-4.45
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.97
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.51
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.07
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4
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