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CAS 108237-91-8 4-bromo-phenyl-(4-phenyl-thiazol-2-yl)-amine molecular structure lightbox
CAS RN: 108237-91-8

4-bromo-phenyl-(4-phenyl-thiazol-2-yl)-amine

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8 package records8 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251130 100mg In stock Inquiry
Batchno.20250914 25mg In stock Inquiry
Batchno.20250715 50mg In stock Inquiry
Batchno.20260125 5mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250329 10mg In stock Shanghai Inquiry
Batchno.20260603 1mg In stock Shanghai, Wuhan Inquiry
Batchno.20250906 5mg In stock Shanghai, Wuhan Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250822 5mg / 10mg / 50mg / 250mg Confirm by inquiry Shanghai, Shandong Inquiry
  • Product code: starshine_CAS108237-91-8
  • Purity/Analytical Methods: >99.0%
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108237-91-8 / N-(4-bromophenyl)-4-phenyl-1,3-thiazol-2-amine

RCGD423 | N-(4-Bromophenyl)-4-phenylthiazol-2-amine | N-(4-bromophenyl)-4-phenyl-1,3-thiazol-2-amine

Standard CAS: 108237-91-8 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
108237-91-8
Multi CAS
No
Molecular Formula
C15H11BrN2S
Molecular Weight
331.200000
Exact Mass
329.982630
SMILES
C1=CC=C(C=C1)C2=CSC(=N2)NC3=CC=C(C=C3)Br
InChI
InChI=1S/C15H11BrN2S/c16-12-6-8-13(9-7-12)17-15-18-14(10-19-15)11-4-2-1-3-5-11/h1-10H,(H,17,18)
InChIKey
OUFYYVAASPLOAA-UHFFFAOYSA-N
Synonyms
RCGD423 N-(4-Bromophenyl)-4-phenylthiazol-2-amine N-(4-bromophenyl)-4-phenyl-1,3-thiazol-2-amine RCGD 423 C15H11BrN2S

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
17
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
1
Molar refractivity
84.97
TPSA
24.92

LogP / Solubility

WLOGP
5.32
MLOGP
4.69
XLogP3
5.2
Consensus LogP
5.07
Log S (ESOL)
-5.71
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.11
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.59
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.97

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Corrosive Acute Toxic
Signal
Danger
GHS Hazard Statements
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501

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