CAS RN: 824393-18-2
AgoMelatine (L(+)-Tartaric 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.20250331 | 10mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS824393-18-2
- Purity/Analytical Methods: >99.0%
824393-18-2 / (2R,3R)-2,3-dihydroxybutanedioic acid;N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
Basic Information
CAS
824393-18-2
Multi CAS
Yes
Molecular Formula
C19H23NO8
Molecular Weight
393.400000
Exact Mass
393.142367
InChI
InChI=1S/C15H17NO2.C4H6O6/c1-11(17)16-9-8-13-5-3-4-12-6-7-14(18-2)10-15(12)13;5-1(3(7)8)2(6)4(9)10/h3-7,10H,8-9H2,1-2H3,(H,16,17);1-2,5-6H,(H,7,8)(H,9,10)/t;1-,2-/m.1/s1
InChIKey
PJOPJXPTFZIKTL-LREBCSMRSA-N
Computed Properties
Structural Parameters
Heavy atom count
28
Aromatic heavy atom count
10
Fraction Csp3
0.32
Rotatable bonds
7
H-bond acceptors
6
H-bond donors
5
Molar refractivity
100.17
TPSA
153.39
LogP / Solubility
WLOGP
0.4
MLOGP
0.38
XLogP3
0.4
Consensus LogP
0.39
Log S (ESOL)
-2.34
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.08
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.39
Class (SILICOS-IT)
Poorly 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)
-4.83
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
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