![CAS 73819-87-1 4-{N-Ethyl-N-[4-(N-phthalimido)butyl]amino}-N-methylphthalim molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/73819-87-1.gif)
CAS RN: 73819-87-1
4-{N-Ethyl-N-[4-(N-phthalimido)butyl]amino}-N-methylphthalim
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260603 | 10mg / 100mg / 500mg | Confirm by inquiry | Shanghai | 8-10 business days | Inquiry |
- Product code: starshine_CAS73819-87-1
- Purity/Analytical Methods: >99.0%
73819-87-1 / 5-[4-(1,3-dioxoisoindol-2-yl)butyl-ethylamino]-2-methylisoindole-1,3-dione
Basic Information
CAS
73819-87-1
Multi CAS
No
Molecular Formula
C23H23N3O4
Molecular Weight
405.400000
Exact Mass
405.168856
InChI
InChI=1S/C23H23N3O4/c1-3-25(15-10-11-18-19(14-15)21(28)24(2)20(18)27)12-6-7-13-26-22(29)16-8-4-5-9-17(16)23(26)30/h4-5,8-11,14H,3,6-7,12-13H2,1-2H3
InChIKey
LPCLCYVTELKQAR-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
30
Aromatic heavy atom count
12
Fraction Csp3
0.3
Rotatable bonds
7
H-bond acceptors
5
Molar refractivity
111.8
TPSA
78
LogP / Solubility
WLOGP
2.82
MLOGP
2.5
XLogP3
2.8
Consensus LogP
2.71
Log S (ESOL)
-3.96
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.92
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.47
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.19
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
3
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