Sliver bis(trifluoromethane sulfonimide)

Introduction

CAS No. :	189114-61-2	MDL No. :	MFCD08457644
Formula :	C2AgF6NO4S2	Boiling Point :	-
Linear Structure Formula :	-	InChI Key :	-
M.W :	388.01	Pubchem ID :	-
Synonyms :	Silver triflimide	Chemical Name :	Sliver bis(trifluoromethane sulfonimide)

Physicochemical Properties

Num. heavy atoms :	16
Num. arom. heavy atoms :	0
Fraction Csp3 :	1.0
Num. rotatable bonds :	2
Num. H-bond acceptors :	11.0
Num. H-bond donors :	0.0
Molar Refractivity :	35.79
TPSA :	85.04 Ų

Pharmacokinetics

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) :	-7.47 cm/s

Lipophilicity

Log Po/w (iLOGP) :	0.0
Log Po/w (XLOGP3) :	1.68
Log Po/w (WLOGP) :	5.36
Log Po/w (MLOGP) :	-0.32
Log Po/w (SILICOS-IT) :	-0.07
Consensus Log Po/w :	1.33

Druglikeness

Lipinski :	0.0
Ghose :	None
Veber :	0.0
Egan :	0.0
Muegge :	2.0
Bioavailability Score :	0.55

Water Solubility

Log S (ESOL) :	-3.17
Solubility :	0.261 mg/ml ; 0.000673 mol/l
Class :	Soluble
Log S (Ali) :	-3.08
Solubility :	0.322 mg/ml ; 0.000831 mol/l
Class :	Soluble
Log S (SILICOS-IT) :	-2.15
Solubility :	2.72 mg/ml ; 0.007 mol/l
Class :	Soluble

Medicinal Chemistry

PAINS :	0.0 alert
Brenk :	0.0 alert
Leadlikeness :	1.0
Synthetic accessibility :	4.3

Signal Word:	Danger	Class:	8
Precautionary Statements:	P280-P305+P351+P338-P310	UN#:	1759
Hazard Statements:	H314	Packing Group:	Ⅲ
GHS Pictogram:

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