기본 정보
- 표준 SMILES
C[Si](C)(C)CCOCn1c(CN(Cc2ccc(CNS(=O)(=O)c3ccccn3)cc2)C2CCCc3cccnc32)nc2ccccc21- InChIKey
YGLLYWUPBWFNLW-UHFFFAOYSA-N- 분자식
- C36H44N6O3SSi
- 평균 분자량
- 668.9 g/mol
이름 및 식별자
- 우선 이름
- pyridine-2-sulfonic acid 4-({(5,6,7,8-tetrahydro-quinolin-8-yl)-[1-(2-trimethylsilanyl-ethoxymethyl)-1H-benzoimidazol-2-ylmethyl]-amino}-methyl)-benzylamide
- IUPAC
- N-[[4-[[5,6,7,8-tetrahydroquinolin-8-yl-[[1-(2-trimethylsilylethoxymethyl)benzimidazol-2-yl]methyl]amino]methyl]phenyl]methyl]pyridine-2-sulfonamide
이름 및 동의어
SCHEMBL4058764YGLLYWUPBWFNLW-UHFFFAOYSA-NPyridine-2-sulfonic Acid 4-({(5,6,7,8-tetrahydro-quinolin-8-yl)-[1-(2-trime thylsilanyl-ethoxymethyl)-1 H-benzoimidazol-2-ylmethyl]-amino}-methyl)-benzylamidePyridine-2-sulfonic acid 4-({(5,6,7,8-tetrahydro-quinolin-8-yl)-[1-(2-trime thylsilanyl-ethoxymethyl)-1H-benzoimidazol-2-ylmethyl]-amino}-methyl)-benzylamidepyridine-2-sulfonic acid 4-({(5,6,7,8-tetrahydro-quinolin-8-yl)-[1-(2-trimethylsilanyl-ethoxymethyl)-1 H-benzoimidazol-2-ylmethyl]-amino}-methyl)-benzylamidepyridine-2-sulfonic acid 4-({(5,6,7,8-tetrahydro-quinolin-8-yl)-[1-(2-trimethylsilanyl-ethoxymethyl)-1H-benzoimidazol-2-ylmethyl]-amino}-methyl)-benzylamide
데이터베이스 식별자
- PubChem CID
- 68896453
물성
구조 계산 물성
- 극성 표면적
- 111 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 14
- 무거운 원자 수
- 47
- 형식 전하
- 0
- 복잡도
- 1,060
관련 반응
6건
연결된 노트
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