4-(3-methoxy-4-phenylmethoxyphenyl)-2,7,7-trimethyl-N-(4-methylpyridin-2-yl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxamide
기본 정보
- CAS
400846-33-5- 표준 SMILES
COc1cc(C2C(C(=O)Nc3cc(C)ccn3)=C(C)NC3=C2C(=O)CC(C)(C)C3)ccc1OCc1ccccc1- InChIKey
ATYGMMWVHMLBQD-UHFFFAOYSA-N- 분자식
- C33H35N3O4
- 평균 분자량
- 537.6 g/mol
이름 및 식별자
- 우선 이름
- 4-(3-methoxy-4-phenylmethoxyphenyl)-2,7,7-trimethyl-N-(4-methylpyridin-2-yl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxamide
- IUPAC
- 4-(3-methoxy-4-phenylmethoxyphenyl)-2,7,7-trimethyl-N-(4-methyl-2-pyridinyl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxamide
- 영어명
- 4-[4-(benzyloxy)-3-methoxyphenyl]-2,7,7-trimethyl-N-(4-methylpyridin-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
- 분자식
- C33H35N3O4
- 분자량
- 537.6487
이름 및 동의어
4-[4-(benzyloxy)-3-methoxyphenyl]-2,7,7-trimethyl-N-(4-methylpyridin-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamideOprea1_386990AN-919/152311194-(3-methoxy-4-phenylmethoxyphenyl)-2,7,7-trimethyl-N-(4-methylpyridin-2-yl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxamide
데이터베이스 식별자
- CAS
400846-33-5
물성
구조 계산 물성
- XLogP
- 5.3
- 극성 표면적
- 89.6 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 40
- 형식 전하
- 0
- 복잡도
- 1,010
관련 반응
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