Chemical Properties of Didesethylflurazepam (CAS 17617-59-3)

InChI

InChI=1S/C17H15ClFN3O/c18-11-5-6-15-13(9-11)17(12-3-1-2-4-14(12)19)21-10-16(23)22(15)8-7-20/h1-6,9H,7-8,10,20H2

InChI Key

MVAUDJDXZPBWOW-UHFFFAOYSA-N

Formula

C17H15ClFN3O

SMILES

NCCN1C(=O)CN=C(c2ccccc2F)c2cc(Cl)ccc21

Molecular Weight¹

331.77

CAS

17617-59-3

Other Names

2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-1-(2-aminoethyl)-7-chloro-5-(2-fluorophenyl)-
1-(2-Aminoethyl)-7-chloro-5-(2-fluorophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one
RO 7-1986
2H-1,4-Benzodiazepin-2-one, 1-(2-aminoethyl)-7-chloro-5-(2-fluorophenyl)-1,3-dihydro-
2H-1,4-Benzodiazepin-2-one, 1-(2-aminoethyl)-7-chloro-5-(o-fluorophenyl)-1,3-dihydro-
Desalkylflurazepam
Dideethylflurazepam
Dealkylflurazepam
N,N-Bisdesethylflurazepam

log₁₀WS : Log10 of Water solubility in mol/l.
logP_oct/wat : Octanol/Water partition coefficient.
McVol : McGowan's characteristic volume (ml/mol).
I_np : Non-polar retention indices.
¹: Molecular weight from the IUPAC atomic weights tables.

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Physical Properties

Property	Value	Unit	Source
log₁₀WS	-3.70		Crippen Calculated Property
logP_oct/wat	2.622		Crippen Calculated Property
McVol	233.230	ml/mol	McGowan Calculated Property
I_np	[2660.00; 2660.00]
I_np	2660.00		NIST
I_np	2660.00		NIST

Similar Compounds

Find more compounds similar to Didesethylflurazepam.

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