CAS RN: 1427316-57-1

N-2-naphthalenyl-9-phenyl-9H-carbazole-2-amine

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Batchno.20260518 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS1427316-57-1
  • Purity/Analytical Methods: >99.0%
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1427316-57-1 / N-naphthalen-2-yl-9-phenylcarbazol-2-amine

Standard CAS: 1427316-57-1 Multi CAS: No

Basic Information

CAS
1427316-57-1
Multi CAS
No
Molecular Formula
C28H20N2
Molecular Weight
384.500000
Exact Mass
384.162649
SMILES
C1=CC=C(C=C1)N2C3=CC=CC=C3C4=C2C=C(C=C4)NC5=CC6=CC=CC=C6C=C5
InChI
InChI=1S/C28H20N2/c1-2-10-24(11-3-1)30-27-13-7-6-12-25(27)26-17-16-23(19-28(26)30)29-22-15-14-20-8-4-5-9-21(20)18-22/h1-19,29H
InChIKey
FLHQREFQXXHDMZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
30
Aromatic heavy atom count
29
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
1
Molar refractivity
128.01
TPSA
16.96

LogP / Solubility

WLOGP
7.68
MLOGP
6.78
XLogP3
7.8
Consensus LogP
7.42
Log S (ESOL)
-7.58
Class (ESOL)
Insoluble
Log S (Ali)
-8.26
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.89
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)
0.39

Drug-likeness / Medicinal Chemistry

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

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