기본 정보
- CAS
102395-70-0- 표준 SMILES
CCOC(=O)C1(c2ccccc2)CCN(c2ccc(C(=O)CCCN3CC=C(c4ccccc4)CC3)cc2)CC1- InChIKey
TZKLOSMKBJLQIO-UHFFFAOYSA-N- 분자식
- C35H40N2O3
- 평균 분자량
- 536.7 g/mol
- 단동위원소 질량
- 536.30389314
이름 및 식별자
- 우선 이름
- Isonipecotic acid, 4-phenyl-1-(p-(4-(4-phenyl-1,2,5,6-tetrahydro-1-pyridyl)butyryl)phenyl)-, ethyl ester
- IUPAC
- ethyl 4-phenyl-1-[4-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butanoyl]phenyl]piperidine-4-carboxylate
- 현지명
- 이소니페콧산,4-페닐-1-(p-(4-(4-페닐-1,2,5,6-테트라히드로-1-피르IDYL)부티르
- 영어명
- ISONIPECOTIC ACID, 4-PHENYL-1-(p-(4-(4-PHENYL-1,2,5,6-TETRAHYDRO-1-PYR IDYL)BUTYR
- 분자식
- C35H40N2O3
- 분자량
- 536.7
이름 및 동의어
102395-70-0Ethyl 4-phenyl-1-(p-(4-(4-phenyl-1,2,5,6-tetrahydro-1-pyridyl)butyryl)phenyl)isonipecotateIsonipecotic acid, 4-phenyl-1-(p-(4-(4-phenyl-1,2,5,6-tetrahydro-1-pyridyl)butyryl)phenyl)-, ethyl esterDTXSID70145018RefChem:349742DTXCID0067509ethyl 4-phenyl-1-[4-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butanoyl]phenyl]piperidine-4-carboxylateethyl 4-phenyl-1-{4-[4-(4-phenyl-3,6-dihydropyridin-1(2h)-yl)butanoyl]phenyl}piperidine-4-carboxylate이소니페콧산,4-페닐-1-(p-(4-(4-페닐-1,2,5,6-테트라히드로-1-피르IDYL)부티르ISONIPECOTIC ACID, 4-PHENYL-1-(p-(4-(4-PHENYL-1,2,5,6-TETRAHYDRO-1-PYR IDYL)BUTYREthyl4-phenyl-1-[4-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butanoyl]phenyl]piperidine-4-carboxylate4-Piperidinecarboxylic acid, 1-[4-[4-(3,6-dihydro-4-phenyl-1(2H)-pyridinyl)-1-oxobutyl]phenyl]-4-phenyl-, ethyl ester
데이터베이스 식별자
- CAS
102395-70-0- PubChem CID
- 59335
물성
구조 계산 물성
- XLogP
- 6.1
- 극성 표면적
- 49.9 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 40
- 형식 전하
- 0
- 복잡도
- 841
화학 및 산업
공급사1 곳
HONEST JOY HOLDINGS LIMITED[email protected]
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