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CAS 832734-15-3 3-bromo-10H-phenoxazine molecular structure lightbox
CAS RN: 832734-15-3

3-bromo-10H-phenoxazine

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250408 100mg / 250mg / 1g / 5g Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS832734-15-3
  • Purity/Analytical Methods: >99.0%
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832734-15-3 / 3-bromo-10H-phenoxazine

Standard CAS: 832734-15-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
832734-15-3
Multi CAS
No
Molecular Formula
BC12H8ORn
Molecular Weight
262.100000
Exact Mass
260.978930
InChI
InChI=1S/C12H8BrNO/c13-8-5-6-10-12(7-8)15-11-4-2-1-3-9(11)14-10/h1-7,14H
InChIKey
HSXDCQJBXRAVSM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
12
H-bond acceptors
2
H-bond donors
1
Molar refractivity
63.94
TPSA
21.26

LogP / Solubility

WLOGP
4.3
MLOGP
3.79
XLogP3
4.5
Consensus LogP
4.2
Log S (ESOL)
-4.77
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.81
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.93
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.27

Drug-likeness / Medicinal Chemistry

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

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