CAS RN: 54-62-6
Aminopterin
Product Availability
Choose a grade to view its available package options.
14 package records13 with current stock4 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250215 | 1ml | In stock | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260325 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20250611 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20260121 | 1g | In stock | Shanghai, Shenzhen | Inquiry | |
| Batchno.20260129 | 1mg | In stock | Shanghai | Inquiry | |
| Batchno.20250513 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20251215 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20260430 | 5g | In stock | Shanghai | Inquiry | |
| Batchno.20260520 | 5mg | In stock | Shanghai | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260619 | 5mg / 20mg / 100mg | Confirm by inquiry | Shanghai | Inquiry |
- Product code: ICTA0410
- Purity/Analytical Methods: >97.0%(T)(HPLC)
54-62-6 / 2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
Basic Information
CAS
54-62-6
Multi CAS
Yes
Molecular Formula
C19H20N8O5
Molecular Weight
440.400000
Exact Mass
440.155666
InChI
InChI=1S/C19H20N8O5/c20-15-14-16(27-19(21)26-15)23-8-11(24-14)7-22-10-3-1-9(2-4-10)17(30)25-12(18(31)32)5-6-13(28)29/h1-4,8,12,22H,5-7H2,(H,25,30)(H,28,29)(H,31,32)(H4,20,21,23,26,27)
InChIKey
TVZGACDUOSZQKY-UHFFFAOYSA-N
Physical Properties
Physical Description
Solid
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
32
Aromatic heavy atom count
16
Fraction Csp3
0.21
Rotatable bonds
9
H-bond acceptors
10
H-bond donors
6
Molar refractivity
113.48
TPSA
219.33
LogP / Solubility
WLOGP
0.24
MLOGP
0.24
XLogP3
-2
Consensus LogP
-0.51
Log S (ESOL)
-2.5
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.35
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.81
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.23
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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