LP-44

Details

Stereochemistry	RACEMIC
Molecular Formula	C27H37N3OS.ClH
Molecular Weight	488.128
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.CSC1=C(C=CC=C1)N2CCN(CCCCCC(=O)NC3CCCC4=CC=CC=C34)CC2

InChI

InChIKey=DWGKCWWWKHCVDH-UHFFFAOYSA-N

InChI=1S/C27H37N3OS.ClH/c1-32-26-15-7-6-14-25(26)30-20-18-29(19-21-30)17-8-2-3-16-27(31)28-24-13-9-11-22-10-4-5-12-23(22)24;/h4-7,10,12,14-15,24H,2-3,8-9,11,13,16-21H2,1H3,(H,28,31);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	C27H37N3OS
Molecular Weight	451.667
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Serotonin 7 (5-HT7) receptor 31 Target ID: CHEMBL3155 Sources: https://www.ncbi.nlm.nih.gov/pubmed/15588097	Agonist 2678		0.22 nM [Ki]

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:06:05 UTC 2023` Edited by `admin` on `Sat Dec 16 18:06:05 UTC 2023`
Record UNII	M5K3JUP5EZ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

LP-44

Code

English

1-Piperazinehexanamide, 4-[2-(methylthio)phenyl]-N-(1,2,3,4-tetrahydro-1-naphthalenyl)-, hydrochloride (1:1)

Systematic Name

English

1-PIPERAZINEHEXANAMIDE, 4-(2-(METHYLTHIO)PHENYL)-N-(1,2,3,4-TETRAHYDRO-1-NAPHTHALENYL)-, MONOHYDROCHLORIDE

Systematic Name

English

Code System Code Type Description

FDA UNII

M5K3JUP5EZ