CAS RN: 4290-94-2
1-ETHYL-1H-INDOLE-2,3-DIONE
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.20250310 | 100mg / 250mg / 1g / 5g | Confirm by inquiry | Shanghai | 8-10 business days | Inquiry |
- Product code: starshine_CAS4290-94-2
- Purity/Analytical Methods: >99.0%
4290-94-2 / 1-ethylindole-2,3-dione
Basic Information
CAS
4290-94-2
Multi CAS
No
Molecular Formula
C10H9NO2
Molecular Weight
175.180000
Exact Mass
175.063329
InChI
InChI=1S/C10H9NO2/c1-2-11-8-6-4-3-5-7(8)9(12)10(11)13/h3-6H,2H2,1H3
InChIKey
ORYSFKVWQQMDAX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.2
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
48.8
TPSA
37.38
LogP / Solubility
WLOGP
1.24
MLOGP
1.08
XLogP3
0.9
Consensus LogP
1.07
Log S (ESOL)
-1.98
Class (ESOL)
Soluble
Log S (Ali)
-1.89
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.94
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.91
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
1.5
Customers Also Viewed
-
-
ACACETIN-7-GLUCOSIDE
- CAS RN: 4291-60-5
- Product Code: starshine_CAS4291-60-5
- Purity/Analytical method: >99.0%
-
Behenyl Trimethyl Ammonium Chloride
- CAS RN: 4292-25-5
- Product Code: starshine_CAS4292-25-5
- Purity/Analytical method: >99.0%
-
-
-
CIS-3-HYDROXY-DL-PROLINE
- CAS RN: 4298-05-9
- Product Code: starshine_CAS4298-05-9
- Purity/Analytical method: >99.0%
