(R)-Methyl 5-(4-(6-benzyl-4,5-dimethylpyridazin-3-yl)-2-methylpiperazin-1-yl)pyrazine-2-carboxylate
기본 정보
- 표준 SMILES
COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1- InChIKey
JDHHLKZLNWGAAV-MRXNPFEDSA-N- 분자식
- C24H28N6O2
- 평균 분자량
- 432.5 g/mol
이름 및 식별자
- 우선 이름
- (R)-Methyl 5-(4-(6-benzyl-4,5-dimethylpyridazin-3-yl)-2-methylpiperazin-1-yl)pyrazine-2-carboxylate
- IUPAC
- methyl 5-[(2R)-4-(6-benzyl-4,5-dimethylpyridazin-3-yl)-2-methylpiperazin-1-yl]pyrazine-2-carboxylate
이름 및 동의어
1204975-11-0(R)-Methyl 5-(4-(6-benzyl-4,5-dimethylpyridazin-3-yl)-2-methylpiperazin-1-yl)pyrazine-2-carboxylateMethyl (R)-5-(4-(6-benzyl-4,5-dimethylpyridazin-3-yl)-2-methylpiperazin-1-yl)pyrazine-2-carboxylatemethyl 5-[(2R)-4-(6-benzyl-4,5-dimethylpyridazin-3-yl)-2-methylpiperazin-1-yl]pyrazine-2-carboxylatestarbld0000768SCHEMBL1140634CHEMBL3971766SCHEMBL30090563JDHHLKZLNWGAAV-MRXNPFEDSA-NMFCD31731511AKOS037651133CS-15962
이름 더 보기
CS-0079516D72352F615285(R)-4-(6-Benzyl-4,5-dimethyl-pyridazin-3-yl)-2-methyl-3,4,5,6-tetrahydro-2H-[1,2']bipyrazinyl-5'-carboxylic acid methyl ester2-Pyrazinecarboxylic acid, 5-[(2R)-4-[4,5-dimethyl-6-(phenylmethyl)-3-pyridazinyl]-2-methyl-1-piperazinyl]-, methyl estermethyl 5-[(2R)-4-(6-benzyl-4,5-dimethyl-pyridazin-3-yl)-2-methyl-piperazin-1-yl]pyrazine-2-carboxylate
데이터베이스 식별자
- PubChem CID
- 59191561
- ChEMBL
CHEMBL3971766
물성
구조 계산 물성
- XLogP
- 3.4
- 극성 표면적
- 84.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 32
- 형식 전하
- 0
- 복잡도
- 615
관련 반응
3건
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