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CAS 378206-75-8 2,4-DICHLORO-5-ISOBUTYLSULFAMOYL-BENZOIC ACID molecular structure lightbox
CAS RN: 378206-75-8

2,4-DICHLORO-5-ISOBUTYLSULFAMOYL-BENZOIC ACID

  • Product code: SSC-145268
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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: 0.25g
  • 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 378206-75-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shenzhen Inquiry

378206-75-8 / 2,4-dichloro-5-(2-methylpropylsulfamoyl)benzoic acid

Standard CAS: 378206-75-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
378206-75-8
Multi CAS
Yes
Molecular Formula
C11H13CL2NO4S
Molecular Weight
326.200000
Exact Mass
324.994235
InChI
InChI=1S/C11H13Cl2NO4S/c1-6(2)5-14-19(17,18)10-3-7(11(15)16)8(12)4-9(10)13/h3-4,6,14H,5H2,1-2H3,(H,15,16)
InChIKey
SNZSFWOSJFUAFS-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
6
Fraction Csp3
0.36
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
2
Molar refractivity
73.45
TPSA
83.47

LogP / Solubility

WLOGP
2.63
MLOGP
2.33
XLogP3
3
Consensus LogP
2.65
Log S (ESOL)
-3.42
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.13
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.56
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.85

Drug-likeness / Medicinal Chemistry

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

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