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CAS RN: 94941-30-7
N-[(9-Ethylcarbazol-3-yl)methylene]-2-methyl-1-indolinylamine
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.20260111 | 200mg | Out of stock | 5-7 business days | Inquiry |
- Product code: ICTE0572
- Purity/Analytical Methods: >98.0%(HPLC)
94941-30-7 / (E)-1-(9-ethylcarbazol-3-yl)-N-(2-methyl-2,3-dihydroindol-1-yl)methanimine
Basic Information
CAS
94941-30-7
Multi CAS
Yes
Molecular Formula
C24H23N3
Molecular Weight
353.500000
Exact Mass
353.189198
InChI
InChI=1S/C24H23N3/c1-3-26-23-11-7-5-9-20(23)21-15-18(12-13-24(21)26)16-25-27-17(2)14-19-8-4-6-10-22(19)27/h4-13,15-17H,3,14H2,1-2H3/b25-16+
InChIKey
TWPXERWDHZWUPC-PCLIKHOPSA-N
Computed Properties
Structural Parameters
Heavy atom count
27
Aromatic heavy atom count
19
Fraction Csp3
0.21
Rotatable bonds
3
H-bond acceptors
3
Molar refractivity
114.8
TPSA
20.53
LogP / Solubility
WLOGP
5.6
MLOGP
4.95
XLogP3
5.9
Consensus LogP
5.48
Log S (ESOL)
-5.88
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.5
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.97
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.9
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4
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