[email protected]
CAS 1456702-54-7 N- [4- (2-naphthyl) phenyl] -9,9-dimethylfluoren-2-amine molecular structure lightbox
CAS RN: 1456702-54-7

N- [4- (2-naphthyl) phenyl] -9,9-dimethylfluoren-2-amine

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251128 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS1456702-54-7
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

1456702-54-7 / 9,9-dimethyl-N-(4-naphthalen-2-ylphenyl)fluoren-2-amine

Standard CAS: 1456702-54-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1456702-54-7
Multi CAS
No
Molecular Formula
C31H25N
Molecular Weight
411.500000
Exact Mass
411.198700
SMILES
CC1(C2=CC=CC=C2C3=C1C=C(C=C3)NC4=CC=C(C=C4)C5=CC6=CC=CC=C6C=C5)C
InChI
InChI=1S/C31H25N/c1-31(2)29-10-6-5-9-27(29)28-18-17-26(20-30(28)31)32-25-15-13-22(14-16-25)24-12-11-21-7-3-4-8-23(21)19-24/h3-20,32H,1-2H3
InChIKey
NXWVPPNTTJUXMA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
32
Aromatic heavy atom count
28
Fraction Csp3
0.1
Rotatable bonds
3
H-bond acceptors
1
H-bond donors
1
Molar refractivity
136.67
TPSA
12.03

LogP / Solubility

WLOGP
8.56
MLOGP
7.56
XLogP3
8.8
Consensus LogP
8.31
Log S (ESOL)
-8.23
Class (ESOL)
Insoluble
Log S (Ali)
-9.11
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.8
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)
0.84

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4

Customers Also Viewed

Get In Touch

Contact Us