(5,7-Dimethyl-benzoxazol-2-yl)-[2-fluoro-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-amine

HCID 22347098

기본 정보

표준 SMILES
Cc1cc(C)c2oc(Nc3ccc(B4OC(C)(C)C(C)(C)O4)cc3F)nc2c1
InChIKey
CUBPMDYANCDZJZ-UHFFFAOYSA-N
분자식
C21H24BFN2O3
평균 분자량
382.2 g/mol
단동위원소 질량
382.186401

이름 및 식별자

우선 이름
(5,7-Dimethyl-benzoxazol-2-yl)-[2-fluoro-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-amine
IUPAC
N-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-5,7-dimethyl-1,3-benzoxazol-2-amine

이름 및 동의어

SCHEMBL1335513CUBPMDYANCDZJZ-UHFFFAOYSA-NDB-096680(5,7-dimethyl-benzoxazol-2-yl)- [2-fluoro-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-amine(5,7-dimethyl-benzoxazol-2-yl)-[2-fluoro-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-amine461701-08-6n-(2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-5,7-dimethylbenzo[d]oxazol-2-amineN2-[2-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-5,7-dimethyl-1,3-benzoxazol-2-amine

데이터베이스 식별자

PubChem CID
22347098

물성

구조 계산 물성

극성 표면적
56.5 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
6
회전 가능 결합 수
3
무거운 원자 수
28

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5건

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