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CAS 101186-77-0 4-Bromo-4′-[di(p-tolyl)amino]stilbene molecular structure lightbox
CAS RN: 101186-77-0

4-Bromo-4′-[di(p-tolyl)amino]stilbene

Product Availability

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4 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260611 1g In stock Inquiry
Batchno.20251231 200mg In stock Inquiry
Batchno.20250208 5g In stock Inquiry
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250930 200mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-002037
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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 101186-77-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shanghai Inquiry

101186-77-0 / N-[4-[2-(4-bromophenyl)ethenyl]phenyl]-4-methyl-N-(4-methylphenyl)aniline

4-Bromo-4'-[di(p-tolyl)amino]stilbene | 4-(4-Bromostyryl)-N,N-di-p-tolylaniline | (BenzenaMine, 4-[2-(4-broMophenyl)ethenyl]-N,N-bis(4-Methylphenyl)-

Standard CAS: 101186-77-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
101186-77-0
Multi CAS
Yes
Molecular Formula
C28H24BrN
Molecular Weight
454.400000
Exact Mass
453.109210
SMILES
CC1=CC=C(C=C1)N(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C=CC4=CC=C(C=C4)Br
InChI
InChI=1S/C28H24BrN/c1-21-3-15-26(16-4-21)30(27-17-5-22(2)6-18-27)28-19-11-24(12-20-28)8-7-23-9-13-25(29)14-10-23/h3-20H,1-2H3
InChIKey
UDHCDVGKGPSNLA-UHFFFAOYSA-N
Synonyms
4-Bromo-4'-[di(p-tolyl)amino]stilbene 4-(4-Bromostyryl)-N,N-di-p-tolylaniline (BenzenaMine, 4-[2-(4-broMophenyl)ethenyl]-N,N-bis(4-Methylphenyl)- MFCD28975103 4-[2-(4-bromophenyl)ethenyl]-N,N-bis(4-methylphenyl)aniline

Computed Properties

Structural Parameters

Heavy atom count
30
Aromatic heavy atom count
24
Fraction Csp3
0.07
Rotatable bonds
5
H-bond acceptors
1
Molar refractivity
133.67
TPSA
3.24

LogP / Solubility

WLOGP
8.71
MLOGP
7.69
XLogP3
8.9
Consensus LogP
8.43
Log S (ESOL)
-8.4
Class (ESOL)
Insoluble
Log S (Ali)
-9.57
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.44
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)
0.69

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

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