PAC-1

Details

Stereochemistry	ACHIRAL
Molecular Formula	C23H28N4O2
Molecular Weight	392.494
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC1=C(CC=C)C=CC=C1\C=N\NC(=O)CN2CCN(CC3=CC=CC=C3)CC2

InChI

InChIKey=YQNRVGJCPCNMKT-LFVJCYFKSA-N

InChI=1S/C23H28N4O2/c1-2-7-20-10-6-11-21(23(20)29)16-24-25-22(28)18-27-14-12-26(13-15-27)17-19-8-4-3-5-9-19/h2-6,8-11,16,29H,1,7,12-15,17-18H2,(H,25,28)/b24-16+

HIDE SMILES / InChI

Molecular Formula	C23H28N4O2
Molecular Weight	392.494
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:50:51 UTC 2023` Edited by `admin` on `Fri Dec 15 18:50:51 UTC 2023`
Record UNII	9LIS8N0B2C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PAC-1

Code

English

1-PIPERAZINEACETIC ACID, 4-(PHENYLMETHYL)-, ((2-HYDROXY-3-(2-PROPENYL)PHENYL)METHYLENE)HYDRAZIDE

Common Name

English

2-(4-BENZYLPIPERAZIN-1-YL)-N-((2-HYDROXY-3-PROP-2-ENYL-PHENYL)METHYLIDENEAMINO)ACETAMIDE

Systematic Name

English

PROCASPASE-ACTIVATING COMPOUND 1

Common Name

English

1-PIPERAZINEACETIC ACID, 4-(PHENYLMETHYL)-, 2-((2-HYDROXY-3-(2-PROPEN-1-YL)PHENYL)METHYLENE)HYDRAZIDE

Common Name

English

Classification Tree Code System Code

FDA ORPHAN DRUG

486615