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CAS 29203-58-5 4-BROMO-N-HYDROXYBENZIMIDOYL CHLORIDE molecular structure lightbox
CAS RN: 29203-58-5

4-BROMO-N-HYDROXYBENZIMIDOYL CHLORIDE

  • Product code: SSC-131607
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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: ≥95%
  • 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 29203-58-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shenzhen Inquiry

29203-58-5 / (1Z)-4-bromo-N-hydroxybenzenecarboximidoyl chloride

Standard CAS: 29203-58-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
29203-58-5
Multi CAS
Yes
Molecular Formula
C7H5BRCLNO
Molecular Weight
234.480000
Exact Mass
232.924300
InChI
InChI=1S/C7H5BrClNO/c8-6-3-1-5(2-4-6)7(9)10-11/h1-4,11H/b10-7-
InChIKey
ZOPFQZFNZNMZEF-YFHOEESVSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
48.32
TPSA
32.59

LogP / Solubility

WLOGP
2.82
MLOGP
2.49
XLogP3
3.4
Consensus LogP
2.9
Log S (ESOL)
-3.41
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.52
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.65
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.15

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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