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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H18F3N3O2
Molecular Weight 425.4031
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(2-Hydroxyphenyl)-3-[(1S)-1-methyl-2-phenylethyl]-5-(trifluoromethyl)pyrido[4,3-d]pyrimidin-4(3H)-one

SMILES

C[C@@H](CC1=CC=CC=C1)N2C(=O)C3=C(C=CN=C3C(F)(F)F)N=C2C4=CC=CC=C4O

InChI

InChIKey=KLURSWGCQQKDCT-AWEZNQCLSA-N
InChI=1S/C23H18F3N3O2/c1-14(13-15-7-3-2-4-8-15)29-21(16-9-5-6-10-18(16)30)28-17-11-12-27-20(23(24,25)26)19(17)22(29)31/h2-12,14,30H,13H2,1H3/t14-/m0/s1

HIDE SMILES / InChI

Molecular Formula C23H18F3N3O2
Molecular Weight 425.4031
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 20:52:08 GMT 2025
Edited
by admin
on Mon Mar 31 20:52:08 GMT 2025
Record UNII
M5I9BC1J6V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(2-Hydroxyphenyl)-3-[(1S)-1-methyl-2-phenylethyl]-5-(trifluoromethyl)pyrido[4,3-d]pyrimidin-4(3H)-one
Preferred Name English
Code System Code Type Description
FDA UNII
M5I9BC1J6V
Created by admin on Mon Mar 31 20:52:08 GMT 2025 , Edited by admin on Mon Mar 31 20:52:08 GMT 2025
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CAS
1018678-64-2
Created by admin on Mon Mar 31 20:52:08 GMT 2025 , Edited by admin on Mon Mar 31 20:52:08 GMT 2025
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PUBCHEM
135948916
Created by admin on Mon Mar 31 20:52:08 GMT 2025 , Edited by admin on Mon Mar 31 20:52:08 GMT 2025
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