기본 정보
- CAS
343218-96-2- 표준 SMILES
CSc1nc(C)c(CN2CCCCC2)c(=O)[nH]1- InChIKey
BRBQHAALAXFSBL-UHFFFAOYSA-N- 분자식
- C12H19N3OS
- 평균 분자량
- 253.37 g/mol
- 단동위원소 질량
- 253.12488341
이름 및 식별자
- 우선 이름
- 6-Methyl-2-methylsulfanyl-5-piperidin-1-ylmethyl-pyrimidin-4-ol
- IUPAC
- 4-methyl-2-methylsulfanyl-5-(piperidin-1-ylmethyl)-1H-pyrimidin-6-one
- 영어명
- 6-Methyl-2-methylsulfanyl-5-piperidin-1-ylmethyl-pyrimidin-4-ol
- 분자식
- C12H19N3OS
- 분자량
- 253.36
이름 및 동의어
343218-96-26-Methyl-2-(methylthio)-5-(piperidin-1-ylmethyl)pyrimidin-4-ol6-Methyl-2-methylsulfanyl-5-piperidin-1-ylmethyl-pyrimidin-4-ol6-methyl-2-(methylsulfanyl)-5-[(piperidin-1-yl)methyl]pyrimidin-4-olDTXSID605054456-methyl-2-(methylsulfanyl)-5-(piperidin-1-ylmethyl)pyrimidin-4-olMFCD06762703AKOS022104167AKOS022507210NS-03815DB-2639436-methyl-2-methylsulfanyl-5-(1-piperidylmethyl)-1H-pyrimidin-4-one
이름 더 보기
6-methyl-2-methylsulfanyl-5-piperidinomethyl-3H-pyrimidin-4-one6-METHYL-2-(METHYLSULFANYL)-5-(1-PIPERIDINYLMETHYL)-4-PYRIMIDINOL4(3H)-Pyrimidinone, 6-methyl-2-(methylthio)-5-(1-piperidinylmethyl)-
4-methyl-2-methylsulfanyl-5-(piperidin-1-ylmethyl)-1H-pyrimidin-6-one6-Methyl-2-(methylsulfanyl)-5-[(piperidin-1-yl)methyl]pyrimidin-4(1H)-one
데이터베이스 식별자
- CAS
343218-96-2
물성
구조 계산 물성
- XLogP
- 1.3
- 극성 표면적
- 70 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 17
- 형식 전하
- 0
- 복잡도
- 370
화학 및 산업
공급사2 곳
OTAVA-BB[email protected]
PRINCETON[email protected]
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