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Details

Stereochemistry ACHIRAL
Molecular Formula C18H19N7O2.2ClH
Molecular Weight 438.311
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PREXASERTIB DIHYDROCHLORIDE

SMILES

Cl.Cl.COC1=CC=CC(OCCCN)=C1C2=CC(NC3=CN=C(C=N3)C#N)=NN2

InChI

InChIKey=KMEIPKXRCJTZBZ-UHFFFAOYSA-N
InChI=1S/C18H19N7O2.2ClH/c1-26-14-4-2-5-15(27-7-3-6-19)18(14)13-8-16(25-24-13)23-17-11-21-12(9-20)10-22-17;;/h2,4-5,8,10-11H,3,6-7,19H2,1H3,(H2,22,23,24,25);2*1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C18H19N7O2
Molecular Weight 365.3892
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:04:37 UTC 2023
Edited
by admin
on Sat Dec 16 11:04:37 UTC 2023
Record UNII
9RFT476U2L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PREXASERTIB DIHYDROCHLORIDE
Common Name English
2-Pyrazinecarbonitrile, 5-[[5-[2-(3-aminopropoxy)-6-methoxyphenyl]-1H-pyrazol-3-yl]amino]-, hydrochloride (1:2)
Systematic Name English
LY-2606368 DIHYDROCHLORIDE
Brand Name English
Code System Code Type Description
CAS
1234015-54-3
Created by admin on Sat Dec 16 11:04:37 UTC 2023 , Edited by admin on Sat Dec 16 11:04:37 UTC 2023
PRIMARY
FDA UNII
9RFT476U2L
Created by admin on Sat Dec 16 11:04:37 UTC 2023 , Edited by admin on Sat Dec 16 11:04:37 UTC 2023
PRIMARY
PUBCHEM
46700755
Created by admin on Sat Dec 16 11:04:37 UTC 2023 , Edited by admin on Sat Dec 16 11:04:37 UTC 2023
PRIMARY
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