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CAS 929539-41-3 4-(10-(2-naphthyl)-9-fluorenyl)-dibenzofuran molecular structure lightbox
CAS RN: 929539-41-3

4-(10-(2-naphthyl)-9-fluorenyl)-dibenzofuran

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260217 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS929539-41-3
  • Purity/Analytical Methods: >99.0%
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929539-41-3 / 4-(10-naphthalen-2-ylanthracen-9-yl)dibenzofuran

Standard CAS: 929539-41-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
929539-41-3
Multi CAS
No
Molecular Formula
C36H22O
Molecular Weight
470.600000
Exact Mass
470.167065
InChI
InChI=1S/C36H22O/c1-2-11-24-22-25(21-20-23(24)10-1)34-27-13-3-5-15-29(27)35(30-16-6-4-14-28(30)34)32-18-9-17-31-26-12-7-8-19-33(26)37-36(31)32/h1-22H
InChIKey
MACPMCKPDULTGV-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
37
Aromatic heavy atom count
37
Rotatable bonds
2
H-bond acceptors
1
Molar refractivity
157.11
TPSA
13.14

LogP / Solubility

WLOGP
10.38
MLOGP
9.17
XLogP3
10.7
Consensus LogP
10.08
Log S (ESOL)
-9.9
Class (ESOL)
Insoluble
Log S (Ali)
-10.91
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-11.57
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
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
1.78

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
6.5

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