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Details

Stereochemistry ACHIRAL
Molecular Formula C30H29FN4O3
Molecular Weight 512.5747
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-[2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-2-methyl-9-(phenylmethoxy)-4H-pyrido[1,2-a]pyrimidin-4-one

SMILES

CC1=C(CCN2CCC(CC2)C3=NOC4=C3C=CC(F)=C4)C(=O)N5C=CC=C(OCC6=CC=CC=C6)C5=N1

InChI

InChIKey=HLQVTMLJQDZIAZ-UHFFFAOYSA-N
InChI=1S/C30H29FN4O3/c1-20-24(30(36)35-14-5-8-26(29(35)32-20)37-19-21-6-3-2-4-7-21)13-17-34-15-11-22(12-16-34)28-25-10-9-23(31)18-27(25)38-33-28/h2-10,14,18,22H,11-13,15-17,19H2,1H3

HIDE SMILES / InChI

Molecular Formula C30H29FN4O3
Molecular Weight 512.5747
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 Wed Apr 02 20:23:54 GMT 2025
Edited
by admin
on Wed Apr 02 20:23:54 GMT 2025
Record UNII
55WGM62UDN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-[2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-2-methyl-9-(phenylmethoxy)-4H-pyrido[1,2-a]pyrimidin-4-one
Systematic Name English
4H-Pyrido[1,2-a]pyrimidin-4-one, 3-[2-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-2-methyl-9-(phenylmethoxy)-
Preferred Name English
Code System Code Type Description
FDA UNII
55WGM62UDN
Created by admin on Wed Apr 02 20:23:54 GMT 2025 , Edited by admin on Wed Apr 02 20:23:54 GMT 2025
PRIMARY
CAS
1056034-13-9
Created by admin on Wed Apr 02 20:23:54 GMT 2025 , Edited by admin on Wed Apr 02 20:23:54 GMT 2025
PRIMARY
PUBCHEM
25259830
Created by admin on Wed Apr 02 20:23:54 GMT 2025 , Edited by admin on Wed Apr 02 20:23:54 GMT 2025
PRIMARY