[4-(2-Bromophenyl)-5-(6-phenylpyridin-3-yl)-4H-1,2,4-triazol-3-yl]-N-(2-methoxyethyl)-N-methylamine
기본 정보
- 표준 SMILES
COCCN(C)c1nnc(-c2ccc(-c3ccccc3)nc2)n1-c1ccccc1Br- InChIKey
SFGQWDKNONDKDO-UHFFFAOYSA-N- 분자식
- C23H22BrN5O
- 평균 분자량
- 464.4 g/mol
이름 및 식별자
- 우선 이름
- [4-(2-Bromophenyl)-5-(6-phenylpyridin-3-yl)-4H-1,2,4-triazol-3-yl]-N-(2-methoxyethyl)-N-methylamine
- IUPAC
- 4-(2-bromophenyl)-N-(2-methoxyethyl)-N-methyl-5-(6-phenyl-3-pyridinyl)-1,2,4-triazol-3-amine
이름 및 동의어
SCHEMBL5831902SFGQWDKNONDKDO-UHFFFAOYSA-N[4-(2-Bromophenyl)-5-(6-phenylpyridin-3-yl)-4H-1,2,4-triazo 1-3-yl]-N-(2-methoxyethyl)-N-methylamine[4-(2-Bromophenyl)-5-(6-phenylpyridin-3-yl)-4H-1,2,4-triazol -3-yl]-N-(2-methoxyethyl)-N-methylamine[4-(2-Bromophenyl)-5-(6-phenylpyridin-3-yl)-4H-1,2,4-triazol-3-yl]-N-(2-methoxyethyl)-N-methylamine[4-(2-bromophenyl)-5-(6-phenylpyridin-3-yl)-4h-1,2,4-triazol-3-yl]-n-(2-methoxyethyl)-n_methylamine
데이터베이스 식별자
- PubChem CID
- 22019250
물성
구조 계산 물성
- XLogP
- 4.3
- 극성 표면적
- 56.1 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 30
- 형식 전하
- 0
- 복잡도
- 520
관련 반응
6건
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