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CAS 1401863-51-1 9-Benzyl-2-bromo-9H-carbazole molecular structure lightbox
CAS RN: 1401863-51-1

9-Benzyl-2-bromo-9H-carbazole

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250524 200mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: SSC-050678
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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 1401863-51-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shenzhen Inquiry

1401863-51-1 / 9-benzyl-2-bromocarbazole

Standard CAS: 1401863-51-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1401863-51-1
Multi CAS
No
Molecular Formula
C19H14BrN
Molecular Weight
336.200000
Exact Mass
335.030960
SMILES
C1=CC=C(C=C1)CN2C3=CC=CC=C3C4=C2C=C(C=C4)Br
InChI
InChI=1S/C19H14BrN/c20-15-10-11-17-16-8-4-5-9-18(16)21(19(17)12-15)13-14-6-2-1-3-7-14/h1-12H,13H2
InChIKey
BFHNUHBRWXASFQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
21
Aromatic heavy atom count
19
Fraction Csp3
0.05
Rotatable bonds
2
H-bond acceptors
1
Molar refractivity
92.69
TPSA
4.93

LogP / Solubility

WLOGP
5.61
MLOGP
4.95
XLogP3
5.6
Consensus LogP
5.39
Log S (ESOL)
-5.99
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.36
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.74
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
No
Log Kp (skin permeation)
-0.79

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3

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