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Details

Stereochemistry ACHIRAL
Molecular Formula C18H25N3.2ClH
Molecular Weight 356.333
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALX-0646 DIHYDROCHLORIDE

SMILES

Cl.Cl.CN(C)CCC1=CNC2=C1C=C(C=C2)C3=CCN(C)CC3

InChI

InChIKey=TUGKEJSQBWUHDJ-UHFFFAOYSA-N
InChI=1S/C18H25N3.2ClH/c1-20(2)9-6-16-13-19-18-5-4-15(12-17(16)18)14-7-10-21(3)11-8-14;;/h4-5,7,12-13,19H,6,8-11H2,1-3H3;2*1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
MOL RATIO 2 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C18H25N3
Molecular Weight 283.4112
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
PK4JWD5P87
Record Status Validated (UNII)
Record Version