CAS RN: 19427-28-2
N-Formyl-L-aspartic acid
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.20250804 | 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS19427-28-2
- Purity/Analytical Methods: >99.0%
19427-28-2 / (2S)-2-formamidobutanedioic acid
Basic Information
CAS
19427-28-2
Multi CAS
No
Molecular Formula
C5H7NO5
Molecular Weight
161.110000
Exact Mass
161.032422
SMILES
C([C@@H](C(=O)O)NC=O)C(=O)O
InChI
InChI=1S/C5H7NO5/c7-2-6-3(5(10)11)1-4(8)9/h2-3H,1H2,(H,6,7)(H,8,9)(H,10,11)/t3-/m0/s1
InChIKey
MQUUQXIFCBBFDP-VKHMYHEASA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Fraction Csp3
0.4
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
3
Molar refractivity
32.88
TPSA
103.7
LogP / Solubility
WLOGP
-1.34
MLOGP
-1.18
XLogP3
-1.3
Consensus LogP
-1.27
Log S (ESOL)
0.34
Class (ESOL)
Highly soluble
Log S (Ali)
0.09
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
-0.2
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.65
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2
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