n-{1 (s)-[4-(3,4-Dichlorobenzyl)piperazin-1-ylmethyl]-2-methylpropyl}-4-methylbenzamide dihydrochloride salt

HCID 9958340

기본 정보

표준 SMILES
Cc1ccc(C(=O)N[C@H](CN2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)C(C)C)cc1.Cl.Cl
InChIKey
SXGPAVQPSZNFLX-MQWQBNKOSA-N
분자식
C24H33Cl4N3O
평균 분자량
521.3 g/mol

이름 및 식별자

우선 이름
n-{1 (s)-[4-(3,4-Dichlorobenzyl)piperazin-1-ylmethyl]-2-methylpropyl}-4-methylbenzamide dihydrochloride salt
IUPAC
N-[(2S)-1-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]-3-methylbutan-2-yl]-4-methylbenzamide;dihydrochloride

이름 및 동의어

SCHEMBL3936111SXGPAVQPSZNFLX-MQWQBNKOSA-Nn-{1 (s)-[4-(3,4-dichlorobenzyl)piperazin-1-ylmethyl]-2-methylpropyl}-4-methylbenzamide dihydrochloride saltn-{1(s)-[4-(3,4-dichlorobenzyl)piperazin-1-ylmethyl]-2-methylpropyl}-4-methylbenzamide dihydrochloride saltn-{1-(s)-[4-(3,4-dichlorobenzyl)piperazin-1-ylmethyl]-2-methylpropyl}-4-methylbenzamide dihydrochloride salt

데이터베이스 식별자

PubChem CID
9958340

물성

구조 계산 물성

극성 표면적
35.6 Ų
수소 결합 공여자 수
3
수소 결합 수용자 수
3
회전 가능 결합 수
7
무거운 원자 수
32

관련 반응

12건

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