기본 정보
- CAS
1382859-41-7- 표준 SMILES
Cn1nnc(-c2ccc(-c3ccc(N4CC(CO)OC4=O)cc3F)cn2)n1- InChIKey
XFALPSLJIHVRKE-UHFFFAOYSA-N- 분자식
- C17H15FN6O3
- 평균 분자량
- 370.3 g/mol
- 단동위원소 질량
- 370.11896652
이름 및 식별자
- 우선 이름
- 3-[3-Fluoro-4-[6-(2-methyl-2H-tetrazol-5-YL)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-2-oxazolidinone
- IUPAC
- 3-[3-fluoro-4-[6-(2-methyltetrazol-5-yl)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one
이름 및 동의어
3-[3-FLUORO-4-[6-(2-METHYL-2H-TETRAZOL-5-YL)-3-PYRIDINYL]PHENYL]-5-(HYDROXYMETHYL)-2-OXAZOLIDINONETedizolid;Torezolid Impurity 23(S)-3-(3-fluoro-4-(6-(2-Methyl-2H-tetrazol-5-yl)pyridin-3-yl)phenyl)-5-(hydroxyMethyl)oxazolidin-2-oneTedizolid Phosphate Impurity GC17H15FN6O3Tedizolid, (R/S)-8M3RFQ55BESCHEMBL3807996SCHEMBL29833257HMS5084N21(5S)-3-{3-fluoro-4-[6-(2-methyl-2H-1,2,3,4-tetrazol-5-yl)pyridin-3-yl]phenyl}-5-(hydroxymethyl)-1,3-oxazolidin-2-ones5278
이름 더 보기
DA-41144(S)-Tedizolid; (S)-3-(3-fluoro-4-(6-(2-methyl-2H-tetrazol-5-yl)pyridin-3-yl)phenyl)-5-(hydroxymethyl)oxazolidin-2-one1382859-41-72-Oxazolidinone, 3-[3-fluoro-4-[6-(2-methyl-2H-tetrazol-5-yl)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-3-[3-fluoro-4-[6-(2-methyltetrazol-5-yl)-3-pyridyl]phenyl]-5-(hydroxymethyl)oxazolidin-2-one3-[3-fluoro-4-[6-(2-methyltetrazol-5-yl)pyridin-3-yl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one
데이터베이스 식별자
- CAS
1382859-41-7- PubChem CID
- 11653580
- UNII
- 8M3RFQ55BE
물성
구조 계산 물성
- XLogP
- 1.4
- 극성 표면적
- 106 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 27
- 형식 전하
- 0
- 복잡도
- 543
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