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Details

Stereochemistry ABSOLUTE
Molecular Formula C31H38FN3O
Molecular Weight 487.6513
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DPI-221

SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)[C@@H](N2C[C@@H](C)N(CC3=CC=CC(F)=C3)C[C@@H]2C)C4=CC=CC=C4

InChI

InChIKey=KEXJLZMJVOTFOY-QEGDFHJFSA-N
InChI=1S/C31H38FN3O/c1-5-33(6-2)31(36)28-17-15-27(16-18-28)30(26-12-8-7-9-13-26)35-21-23(3)34(20-24(35)4)22-25-11-10-14-29(32)19-25/h7-19,23-24,30H,5-6,20-22H2,1-4H3/t23-,24+,30+/m1/s1

HIDE SMILES / InChI

Molecular Formula C31H38FN3O
Molecular Weight 487.6513
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:01:45 GMT 2023
Edited
by admin
on Sat Dec 16 08:01:45 GMT 2023
Record UNII
X9LJN69TFK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DPI-221
Code English
DPI221
Code English
N,N-DIETHYL-4-((S)-((2S,5R)-4-((3-FLUOROPHENYL)METHYL)-2,5-DIMETHYL-1-PIPERAZINYL)PHENYLMETHYL)BENZAMIDE
Systematic Name English
BENZAMIDE, N,N-DIETHYL-4-((S)-((2S,5R)-4-((3-FLUOROPHENYL)METHYL)-2,5-DIMETHYL-1-PIPERAZINYL)PHENYLMETHYL)-
Systematic Name English
4-((.ALPHA.S)-.ALPHA.-((2S,5R)-2,5-DIMETHYL-4-(3-FLUOROBENZYL)-1-PIPERAZINYL)BENZYL)-N,N-DIETHYLBENZAMIDE
Systematic Name English
Code System Code Type Description
CAS
519058-15-2
Created by admin on Sat Dec 16 08:01:45 GMT 2023 , Edited by admin on Sat Dec 16 08:01:45 GMT 2023
PRIMARY
PUBCHEM
9891642
Created by admin on Sat Dec 16 08:01:45 GMT 2023 , Edited by admin on Sat Dec 16 08:01:45 GMT 2023
PRIMARY
FDA UNII
X9LJN69TFK
Created by admin on Sat Dec 16 08:01:45 GMT 2023 , Edited by admin on Sat Dec 16 08:01:45 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY