2-[6-(1-adamantyl)-3-cyanopyridin-2-yl]sulfanyl-N-(1,3-benzothiazol-2-yl)acetamide
기본 정보
- CAS
313379-93-0- 표준 SMILES
N#Cc1ccc(C23CC4CC(CC(C4)C2)C3)nc1SCC(=O)Nc1nc2ccccc2s1- InChIKey
FQLHKSDBAIXWFG-UHFFFAOYSA-N- 분자식
- C25H24N4OS2
- 평균 분자량
- 460.6 g/mol
이름 및 식별자
- 우선 이름
- 2-[6-(1-adamantyl)-3-cyanopyridin-2-yl]sulfanyl-N-(1,3-benzothiazol-2-yl)acetamide
- IUPAC
- 2-[[6-(1-adamantyl)-3-cyano-2-pyridinyl]sulfanyl]-N-(1,3-benzothiazol-2-yl)acetamide
- 영어명
- 2-{[6-(1-adamantyl)-3-cyanopyridin-2-yl]sulfanyl}-N-(1,3-benzothiazol-2-yl)acetamide
- 분자식
- C25H24N4OS2
- 분자량
- 460.61426
이름 및 동의어
313379-93-02-{[6-(adamantan-1-yl)-3-cyanopyridin-2-yl]sulfanyl}-N-(1,3-benzothiazol-2-yl)acetamide2-[6-(1-adamantyl)-3-cyanopyridin-2-yl]sulfanyl-N-(1,3-benzothiazol-2-yl)acetamide2-((6-(Adamantan-1-yl)-3-cyanopyridin-2-yl)thio)-N-(benzo[d]thiazol-2-yl)acetamide2-{[6-(1-adamantyl)-3-cyano-2-pyridinyl]sulfanyl}-N-(1,3-benzothiazol-2-yl)acetamideN-(1,3-benzothiazol-2-yl)-2-({3-cyano-6-[(3s,5s,7s)-tricyclo[3.3.1.1~3,7~]dec-1-yl]pyridin-2-yl}sulfanyl)acetamide2-[[6-(1-adamantyl)-3-cyano-2-pyridyl]sulfanyl]-N-(1,3-benzothiazol-2-yl)acetamide2-{[6-(1-ADAMANTYL)-3-CYANO-2-PYRIDYL]SULFANYL}-N-(1,3-BENZOTHIAZOL-2-YL)ACETAMIDEOprea1_076026AK-777/36506004C25H24N4OS2STK331203
이름 더 보기
2-{[6-(1-adamantyl)-3-cyanopyridin-2-yl]sulfanyl}-N-(1,3-benzothiazol-2-yl)acetamide
AKOS003792886AKOS005438704SS-0913ST010086CS-0333132SR-01000423401SR-01000423401-12-(6-adamantanyl-3-cyano(2-pyridylthio))-N-benzothiazol-2-ylacetamide
데이터베이스 식별자
- CAS
313379-93-0
물성
구조 계산 물성
- XLogP
- 6
- 극성 표면적
- 132 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 32
- 형식 전하
- 0
- 복잡도
- 740
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