Ro 28-2653

CAS:

Other names: (a barbituric derivative)

SMILES: C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3(C(=O)NC(=O)NC3=O)C4=CC=C(C=C4)C5=CC=CC=C5

Properties

MW	HBA	HBD	LogP	TPSA	Rot.	Comp.	Fsp3C	Brutto formula
485.49	8	2	3.83	127.57	5	122	0.19	C26H23N5O5

Availability

Suppliers	Supplier IDs	Storage	Storage ID	Quantity	Class	Added
			SF_C1250	None		Jan. 1, 2023

Bar codes

Plate barcode	Sample barcode

PAINS

Identified PAINS
Not checked

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[Ro 28-2653]	3.32		7.0	37.0	HPLC-method	Bertholet Pascal 2005
[g-Cyclodextrin](1).[Ro 28-2653]	2.54		7.0	37.0	HPLC-method	Bertholet Pascal 2005
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[Ro 28-2653]	4.10		7.0	37.0	HPLC-method	Bertholet Pascal 2005
[Randomly methylated-b-Cyclodextrin (DS ~12)](1).[Ro 28-2653]	4.44		7.0	37.0	HPLC-method	Bertholet Pascal 2005
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](2).[Ro 28-2653]	1.16		7.0	37.0	HPLC-method	Bertholet Pascal 2005
[Randomly methylated-b-Cyclodextrin (DS ~12)](2).[Ro 28-2653]	1.36		7.0	37.0	HPLC-method	Bertholet Pascal 2005

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