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CAS 2095887-12-8 11-[1,1′-biphenyl]-4-yl-11,12-dihydroindolo[2,3-a]carbazole molecular structure lightbox
CAS RN: 2095887-12-8

11-[1,1′-biphenyl]-4-yl-11,12-dihydroindolo[2,3-a]carbazole

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260105 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-099392
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 2095887-12-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Beijing Inquiry

2095887-12-8 / 12-(4-phenylphenyl)-11H-indolo[2,3-a]carbazole

Standard CAS: 2095887-12-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
2095887-12-8
Multi CAS
No
Molecular Formula
C30H20N2
Molecular Weight
408.500000
Exact Mass
408.162649
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)N3C4=CC=CC=C4C5=C3C6=C(C=C5)C7=CC=CC=C7N6
InChI
InChI=1S/C30H20N2/c1-2-8-20(9-3-1)21-14-16-22(17-15-21)32-28-13-7-5-11-24(28)26-19-18-25-23-10-4-6-12-27(23)31-29(25)30(26)32/h1-19,31H
InChIKey
ACVLKHCAFDVCHM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
32
Aromatic heavy atom count
32
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
135.58
TPSA
20.72

LogP / Solubility

WLOGP
8.09
MLOGP
7.14
XLogP3
8.1
Consensus LogP
7.78
Log S (ESOL)
-8.07
Class (ESOL)
Insoluble
Log S (Ali)
-8.75
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.27
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)
0.53

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4.5

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