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CAS 130825-13-7 3,6-Dichloro-4-iodopyridazine molecular structure lightbox
CAS RN: 130825-13-7

3,6-Dichloro-4-iodopyridazine

  • Product code: SSC-037374
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g, 5g
  • Available purity: ≥95%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 130825-13-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 2 In Stock Shanghai Inquiry
0.25g ≥95% 2 In Stock Hong Kong Inquiry
1g ≥95% 2 In Stock Beijing Inquiry
5g ≥95% 0 Out of Stock Shanghai Inquiry

130825-13-7 / 3,6-dichloro-4-iodopyridazine

Standard CAS: 130825-13-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
130825-13-7
Multi CAS
No
Molecular Formula
C4HCl2IN2
Molecular Weight
274.870000
Exact Mass
273.856150
SMILES
C1=C(C(=NN=C1Cl)Cl)I
InChI
InChI=1S/C4HCl2IN2/c5-3-1-2(7)4(6)9-8-3/h1H
InChIKey
DOZGQZSLDJZZMV-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Aromatic heavy atom count
6
H-bond acceptors
2
Molar refractivity
44.77
TPSA
25.78

LogP / Solubility

WLOGP
2.39
MLOGP
2.11
XLogP3
2.4
Consensus LogP
2.3
Log S (ESOL)
-3.54
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.54
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.43
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)
-2.7

Drug-likeness / Medicinal Chemistry

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

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