2-Methyl-3-{4-[2-(5-methyl-2-phenyl-oxazol-4-yl)-ethoxy]-3-propyl-phenyl}-2-phenoxy-propionic Acid Ethyl Ester
기본 정보
- 표준 SMILES
CCCc1cc(CC(C)(Oc2ccccc2)C(=O)OCC)ccc1OCCc1nc(-c2ccccc2)oc1C- InChIKey
URLARWGZNPBVDZ-UHFFFAOYSA-N- 분자식
- C33H37NO5
- 평균 분자량
- 527.6 g/mol
- 단동위원소 질량
- 527.26717328
이름 및 식별자
- 우선 이름
- 2-Methyl-3-{4-[2-(5-methyl-2-phenyl-oxazol-4-yl)-ethoxy]-3-propyl-phenyl}-2-phenoxy-propionic Acid Ethyl Ester
- IUPAC
- ethyl 2-methyl-3-[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]-3-propylphenyl]-2-phenoxypropanoate
이름 및 동의어
SCHEMBL5112995URLARWGZNPBVDZ-UHFFFAOYSA-N2-Methyl-3-{4-[2-(5-methyl-2-phenyl-oxazol-4-yl)-ethoxy]-3-propyl-phenyl}-2-phenoxy-propionic Acid Ethyl Ester3-{4-[2-(5-methyl-2-phenyl-oxazol-4-yl)-ethoxy]-3-propyl-phenyl}-2-methyl-2-phenoxy-propionic acid ethyl ester3-{4-[2-(5-methyl-2-phenyloxazol-4-yl)-ethoxy]-3-propyl-phenyl}-2-methyl-2-phenoxy-propionic acid ethyl ester
데이터베이스 식별자
- PubChem CID
- 20823137
물성
구조 계산 물성
- XLogP
- 8.1
- 극성 표면적
- 70.8 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 14
- 무거운 원자 수
- 39
- 형식 전하
- 0
- 복잡도
- 721
관련 반응
6건
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