기본 정보
- 표준 SMILES
CC(=O)Nc1nc2ccc(B3OC(C)(C)C(C)(C)O3)cc2s1- InChIKey
CBVRCXVIFJCOJK-UHFFFAOYSA-N- 분자식
- C15H19BN2O3S
- 평균 분자량
- 318.2 g/mol
이름 및 식별자
- 우선 이름
- n-(6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]thiazol-2-yl)acetamide
- IUPAC
- N-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-benzothiazol-2-yl]acetamide
이름 및 동의어
885069-14-7n-(6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]thiazol-2-yl)acetamideN-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-benzothiazol-2-yl]acetamideMFCD22571502N-[6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-2-benzothiazolyl]acetamideC15H19BN2O3SSCHEMBL799198CBVRCXVIFJCOJK-UHFFFAOYSA-NAKOS027422970N-[6-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzothiazol-2-yl]-acetamideAS-55263DB-027009
이름 더 보기
CS-0099934A10717A1-185132-(Acetamido)benzothiazole-6-boronic acid pinacol ester, 97%N-(6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]thiazol-2-yl) acetamiden-[6-(4,4,5,5-tetramethyl-[1.3,2]dioxaborolan-2-yl)-benzothiazol-2-yl]-acetamiden-(6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]thiazol-2-yl)acetamide, 885069-14-7, SCHEMBL799198, CBVRCXVIFJCOJK-UHFFFAOYSA-N, DB-027009, KB-274736, n-(6-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)benzo[d]thiazol-2-yl)acetamide, N-[6-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzothiazol-2-yl]-acetamide
데이터베이스 식별자
- PubChem CID
- 51354026
물성
구조 계산 물성
- 극성 표면적
- 88.7 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 22
- 형식 전하
- 0
- 복잡도
- 444
관련 반응
47건
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