CAS RN: 2478531-86-9
9H-Fluoren-2-amine, 9,9-dimethyl-N-(4′-methyl[1,1′-biphenyl]-2-yl)-
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20260103 |
100mg / 250mg / 1g |
Out of stock |
5-7 business days | Inquiry |
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Product code:
starshine_CAS2478531-86-9
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Purity/Analytical Methods:
>99.0%
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2478531-86-9 / 9,9-dimethyl-N-[2-(4-methylphenyl)phenyl]fluoren-2-amine
Standard CAS: 2478531-86-9
Multi CAS: No
Basic Information
CAS
2478531-86-9
Multi CAS
No
Molecular Formula
C28H25N
Molecular Weight
375.500000
Exact Mass
375.198700
InChI
InChI=1S/C28H25N/c1-19-12-14-20(15-13-19)22-8-5-7-11-27(22)29-21-16-17-24-23-9-4-6-10-25(23)28(2,3)26(24)18-21/h4-18,29H,1-3H3
InChIKey
XCODBJZPVLLOJH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
29
Aromatic heavy atom count
24
Fraction Csp3
0.14
Rotatable bonds
3
H-bond acceptors
1
H-bond donors
1
Molar refractivity
123.9
TPSA
12.03
LogP / Solubility
WLOGP
7.71
MLOGP
6.81
XLogP3
8
Consensus LogP
7.51
Log S (ESOL)
-7.44
Class (ESOL)
Insoluble
Log S (Ali)
-8.21
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.86
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)
0.46
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5