기본 정보
- 표준 SMILES
CC(C)(C)OC(=O)N1CCC(c2nc(CCl)cs2)CC1- InChIKey
OISDRMFIITXOTB-UHFFFAOYSA-N- 분자식
- C14H21ClN2O2S
- 평균 분자량
- 316.8 g/mol
이름 및 식별자
- 우선 이름
- Tert-butyl 4-[4-(chloromethyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate
- IUPAC
- tert-butyl 4-[4-(chloromethyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate
이름 및 동의어
650579-82-1tert-Butyl 4-(4-(chloromethyl)thiazol-2-yl)piperidine-1-carboxylatetert-butyl 4-[4-(chloromethyl)-1,3-thiazol-2-yl]piperidine-1-carboxylatetert-Butyl 4-[4-(chloromethyl)thiazol-2-yl]piperidine-1-carboxylateSCHEMBL907209OISDRMFIITXOTB-UHFFFAOYSA-NMFCD200403734-(4-Chloromethyl-thiazol-2-yl)-piperidine-1-carboxylic acid tert-butyl ester4-[4-(chloromethyl)-2-thiazolyl]-1-Piperidinecarboxylic acid 1,1-dimethylethyl esterDB-357825CS-0057915tert-Butyl4-(4-(chloromethyl)thiazol-2-yl)piperidine-1-carboxylate
이름 더 보기
1,1-dimethylethyl 4-[4-(chloromethyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate1-(1,1-dimethylethyl) 4-(4-chloromethyl-2-thiazolyl)-1-piperidine-carboxylate1-(1,1-dimethylethyl) 4-(4-chloromethyl-2-thiazolyl)-1-piperidinecarboxylate
데이터베이스 식별자
- PubChem CID
- 57423790
물성
구조 계산 물성
- XLogP
- 2.8
- 극성 표면적
- 70.7 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 20
- 형식 전하
- 0
- 복잡도
- 341
관련 반응
31건
화합물 노트
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