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CAS 242-50-2 6H-Dibenzo[b,h]carbazole molecular structure lightbox
CAS RN: 242-50-2

6H-Dibenzo[b,h]carbazole

  • Product code: SSC-118229
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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: 5g
  • Available purity: ≥98%
  • 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 242-50-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥98% 0 Out of Stock Hong Kong Inquiry

242-50-2 / 12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene

Standard CAS: 242-50-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
242-50-2
Multi CAS
No
Molecular Formula
C20H13N
Molecular Weight
267.300000
Exact Mass
267.104799
SMILES
C1=CC=C2C=C3C(=CC2=C1)C4=CC5=CC=CC=C5C=C4N3
InChI
InChI=1S/C20H13N/c1-3-7-15-11-19-17(9-13(15)5-1)18-10-14-6-2-4-8-16(14)12-20(18)21-19/h1-12,21H
InChIKey
VWYJRLCUBVCRPR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
21
Aromatic heavy atom count
21
H-bond donors
1
Molar refractivity
90.82
TPSA
15.79

LogP / Solubility

WLOGP
5.63
MLOGP
4.96
XLogP3
5.3
Consensus LogP
5.3
Log S (ESOL)
-5.78
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.82
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.07
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.36

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5

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