4-Hydroxy-2-(hydroxymethyl)-3-methoxy-N-[2-[3-methoxy-4-(phenylmethoxy)phenyl]ethyl]-benzeneacetamide
기본 정보
- CAS
1359829-25-6- 표준 SMILES
COc1cc(CCNC(=O)Cc2ccc(O)c(OC)c2CO)ccc1OCc1ccccc1- InChIKey
JYZHXVUVMJWNBM-UHFFFAOYSA-N- 분자식
- C26H29NO6
- 평균 분자량
- 451.5 g/mol
- 단동위원소 질량
- 451.19948764
이름 및 식별자
- 우선 이름
- 4-Hydroxy-2-(hydroxymethyl)-3-methoxy-N-[2-[3-methoxy-4-(phenylmethoxy)phenyl]ethyl]-benzeneacetamide
- IUPAC
- 2-[4-hydroxy-2-(hydroxymethyl)-3-methoxyphenyl]-N-[2-(3-methoxy-4-phenylmethoxyphenyl)ethyl]acetamide
이름 및 동의어
1359829-25-6DTXSID5011139704-Hydroxy-2-(hydroxymethyl)-3-methoxy-N-[2-[3-methoxy-4-(phenylmethoxy)phenyl]ethyl]-benzeneacetamide2-[4-hydroxy-2-(hydroxymethyl)-3-methoxyphenyl]-N-[2-(3-methoxy-4-phenylmethoxyphenyl)ethyl]acetamide4-Hydroxy-2-(hydroxymethyl)-3-methoxy-N-[2-[3-methoxy-4-(phenylmethoxy)phenyl]ethyl]benzeneacetamideN-{2-[4-(Benzyloxy)-3-methoxyphenyl]ethyl}-2-[4-hydroxy-2-(hydroxymethyl)-3-methoxyphenyl]acetamide
데이터베이스 식별자
- CAS
1359829-25-6- PubChem CID
- 56605340
- DTXSID
DTXSID501113970
물성
구조 계산 물성
- XLogP
- 3.3
- 극성 표면적
- 97.3 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 33
- 형식 전하
- 0
- 복잡도
- 569
관련 반응
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