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CAS 478556-66-0 1-[9-Ethyl-6-(2-methylbenzoyl)-9H-carbazol-3-yl]ethanone 1-(O-acetyloxime) molecular structure lightbox
CAS RN: 478556-66-0

1-[9-Ethyl-6-(2-methylbenzoyl)-9H-carbazol-3-yl]ethanone 1-(O-acetyloxime)

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251023 100g In stock Shanghai Inquiry
Batchno.20260513 1g In stock Shanghai, Shandong, Hebei Inquiry
Batchno.20250426 25g In stock Shanghai, Shandong Inquiry
Batchno.20260602 5g In stock Shanghai, Shandong, Guangdong Inquiry
  • Product code: starshine_CAS478556-66-0
  • Purity/Analytical Methods: >99.0%
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478556-66-0 / [(Z)-1-[9-ethyl-6-(2-methylbenzoyl)carbazol-3-yl]ethylideneamino] acetate

Standard CAS: 478556-66-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
478556-66-0
Multi CAS
Yes
Molecular Formula
C26H24N2O3
Molecular Weight
412.500000
Exact Mass
412.178693
InChI
InChI=1S/C26H24N2O3/c1-5-28-24-12-10-19(17(3)27-31-18(4)29)14-22(24)23-15-20(11-13-25(23)28)26(30)21-9-7-6-8-16(21)2/h6-15H,5H2,1-4H3/b27-17-
InChIKey
SEEVRZDUPHZSOX-PKAZHMFMSA-N

Computed Properties

Structural Parameters

Heavy atom count
31
Aromatic heavy atom count
19
Fraction Csp3
0.19
Rotatable bonds
5
H-bond acceptors
5
Molar refractivity
123.71
TPSA
60.66

LogP / Solubility

WLOGP
5.64
MLOGP
4.99
XLogP3
5.4
Consensus LogP
5.34
Log S (ESOL)
-6.07
Class (ESOL)
Insoluble
Log S (Ali)
-7.02
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.62
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
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)
-1.23

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
3

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