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CAS 61966-14-1 FAST CORINTH V ZINC CHLORIDE DOUBLE SALT molecular structure lightbox
CAS RN: 61966-14-1

FAST CORINTH V ZINC CHLORIDE DOUBLE SALT

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251219 25g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS61966-14-1
  • Purity/Analytical Methods: >99.0%
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61966-14-1 / dichlorozinc;2-methoxy-5-methyl-4-[(4-methyl-2-nitrophenyl)diazenyl]benzenediazonium;dichloride

Standard CAS: 61966-14-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
61966-14-1
Multi CAS
Yes
Molecular Formula
C15H14CL4N5O3ZN
Molecular Weight
519.500000
Exact Mass
517.911267
InChI
InChI=1S/C15H14N5O3.4ClH.Zn/c1-9-4-5-11(14(6-9)20(21)22)18-19-12-8-15(23-3)13(17-16)7-10(12)2;;;;;/h4-8H,1-3H3;4*1H;/q+1;;;;;+2/p-4
InChIKey
UKPOXYQJNVCCET-UHFFFAOYSA-J

Computed Properties

Structural Parameters

Heavy atom count
28
Aromatic heavy atom count
12
Fraction Csp3
0.2
Rotatable bonds
4
H-bond acceptors
6
Molar refractivity
96.19
TPSA
105.24

LogP / Solubility

WLOGP
0.5
MLOGP
0.48
XLogP3
0.5
Consensus LogP
0.49
Log S (ESOL)
-3.43
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.18
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-3.94
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.53

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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