기본 정보
- CAS
193359-26-1- 표준 SMILES
Cc1ccc(CC2(O)CCN(CCOc3ccc(O)cc3)CC2)cc1- InChIKey
VKMFDKYCIKEDMR-UHFFFAOYSA-N- 분자식
- C21H27NO3
- 평균 분자량
- 341.4 g/mol
개요
1-[2-(4-hydroxyphenoxy)ethyl]-4-[(4-methylphenyl)methyl]-4-piperidinol is a member of piperidines.
이름 및 식별자
- 우선 이름
- Co-101244
- IUPAC
- 1-[2-(4-hydroxyphenoxy)ethyl]-4-[(4-methylphenyl)methyl]piperidin-4-ol
- 영어명
- 1-[2-(4-Hydroxyphenoxy)ethyl]-4-[(4-methylphenyl)methyl]-4-piperidinol monohydrochloride
- 분자식
- C21H27NO3
- 분자량
- 341.44
이름 및 동의어
193359-26-1Co 101244Co-101244Q85IYK36S4PD-174494RO-63-19081-(2-(4-Hydroxyphenoxy)ethyl)-4-((4-methylphenyl)methyl)-4-piperidinol4-Piperidinol, 1-(2-(4-hydroxyphenoxy)ethyl)-4-((4-methylphenyl)methyl)-1-[2-(4-hydroxyphenoxy)ethyl]-4-[(4-methylphenyl)methyl]-4-piperidinolRefChem:2002241-(2-(4-hydroxyphenoxy)ethyl)-4-(4-methylbenzyl)piperidin-4-olCHEMBL317229
이름 더 보기
184832CO-101244 Free BaseCO 101244 HYDROCHLORIDE4-Piperidinol, 1-[2-(4-hydroxyphenoxy)ethyl]-4-[(4-Methylphenyl)Methyl]-1-[2-(4-Hydroxyphenoxy)ethyl]-4-[(4-methylphenyl)methyl]-4-piperidinolhydrochloride
NCGC00161413-011-[2-(4-HYDROXYPHENOXY)ETHYL]-4-[(4-METHYLPHENYL)METHYL]-4-PIPERIDINOL MONOHYDROCHLORIDEUNII-Q85IYK36S4SCHEMBL499394orb1739425CHEBI:92975BDBM50079385Pd 174494
데이터베이스 식별자
- CAS
193359-26-1
물성
구조 계산 물성
- XLogP
- 3.6
- 극성 표면적
- 52.9 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 25
- 형식 전하
- 0
- 복잡도
- 379
물리화학적 성질
- 끓는 점
- 527.9 · 527.9±45.0 °C(Predicted)
- 밀도
- 1.169 · 1.169±0.06 g/cm3(Predicted)
- 저장 조건
- 4 °C · Store at +4°C
- 산도 계수 (pKa)
- 10.31 · 10.31±0.15(Predicted)
화학 및 산업
응용 분야
용도Co 101244 is a highly selective N-methyl-D-aspartate NR2B subtype antagonist.
공급사9 곳
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
无锡捷化医药科技有限公司83588313 18800520310 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
EMMX Biotechnology LLC888-539-0666 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]
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