CAS RN: 19287-68-4
9,9′-(1,4-phenylene)bis-9H-Carbazole
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20251017 | 250mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS19287-68-4
- Purity/Analytical Methods: >99.0%
19287-68-4 / 9-(4-carbazol-9-ylphenyl)carbazole
Basic Information
CAS
19287-68-4
Multi CAS
No
Molecular Formula
C30H20N2
Molecular Weight
408.500000
Exact Mass
408.162649
SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC=C(C=C4)N5C6=CC=CC=C6C7=CC=CC=C75
InChI
InChI=1S/C30H20N2/c1-5-13-27-23(9-1)24-10-2-6-14-28(24)31(27)21-17-19-22(20-18-21)32-29-15-7-3-11-25(29)26-12-4-8-16-30(26)32/h1-20H
InChIKey
FPMQTZDVSUPPCB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
32
Aromatic heavy atom count
32
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
135.12
TPSA
9.86
LogP / Solubility
WLOGP
7.88
MLOGP
6.96
XLogP3
8.1
Consensus LogP
7.65
Log S (ESOL)
-7.95
Class (ESOL)
Insoluble
Log S (Ali)
-8.6
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.1
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)
0.38
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4.5
