CAS RN: 92-32-0

PYRONIN Y

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4 package records4 with current stock2 grade groups
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Batchno.20260505 1g / 5g / 25g / 100g Confirm by inquiry Shanghai, Shandong, Guangdong, Chongqing Inquiry
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  • Product code: starshine_CAS92-32-0
  • Purity/Analytical Methods: >99.0%
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92-32-0 / [6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium chloride

Standard CAS: 92-32-0 Multi CAS: Yes

Basic Information

CAS
92-32-0
Multi CAS
Yes
Molecular Formula
C17H19CLN2O
Molecular Weight
302.800000
Exact Mass
302.118591
InChI
InChI=1S/C17H19N2O.ClH/c1-18(2)14-7-5-12-9-13-6-8-15(19(3)4)11-17(13)20-16(12)10-14;/h5-11H,1-4H3;1H/q+1;/p-1
InChIKey
INCIMLINXXICKS-UHFFFAOYSA-M

Physical Properties

Physical Description
Lustrous green solid; [Merck Index] Iridescent green crystals
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
21
Aromatic heavy atom count
14
Fraction Csp3
0.24
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
84.28
TPSA
19.39

LogP / Solubility

WLOGP
-0.36
MLOGP
-0.3
XLogP3
-0.36
Consensus LogP
-0.34
Log S (ESOL)
-1.92
Class (ESOL)
Soluble
Log S (Ali)
-1.78
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.45
Class (SILICOS-IT)
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)
-4.82

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5

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