기본 정보
- CAS
5978-92-7- 표준 SMILES
O=C(O)c1cc2ccccc2c(Cc2c(O)c(C(=O)OCCOCCN3CCN(C(c4ccccc4)c4ccc(Cl)cc4)CC3)cc3ccccc23)c1O- InChIKey
YENRTVJWRCAGEM-UHFFFAOYSA-N- 분자식
- C44H41ClN2O7
- 평균 분자량
- 745.3 g/mol
- 단동위원소 질량
- 744.2602293
이름 및 식별자
- 우선 이름
- 4-((3-((2-(2-(4-((4-Chlorophenyl)(phenyl)methyl)piperazin-1-yl)ethoxy)ethoxy)carbonyl)-2-hydroxynaphthalen-1-yl)methyl)-3-hydroxynaphthalene-2-carboxylic acid
- IUPAC
- 4-[[3-[2-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]ethoxycarbonyl]-2-hydroxynaphthalen-1-yl]methyl]-3-hydroxynaphthalene-2-carboxylic acid
- 현지명
- 하이드록시진파모에이트(에스테르)
- 영어명
- Hydroxyzine pamoate (ester)
- 분자식
- C44H41ClN2O7
- 분자량
- 745.26
이름 및 동의어
5978-92-7DTXSID709751954-[(3-{[2-(2-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}ethoxy)ethoxy]carbonyl}-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid4-((3-((2-(2-(4-((4-Chlorophenyl)(phenyl)methyl)piperazin-1-yl)ethoxy)ethoxy)carbonyl)-2-hydroxynaphthalen-1-yl)methyl)-3-hydroxynaphthalene-2-carboxylic acidRefChem:1069643DTXCID501402604Hydroxyzine pamoate (ester)4-[[3-[2-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]ethoxycarbonyl]-2-hydroxynaphthalen-1-yl]methyl]-3-hydroxynaphthalene-2-carboxylic acid2-Naphthoic acid, 4,4'-methylenebis(3-hydroxy-, ester with 2-(2-(4-(p-chloro-alpha-phenylbenzyl)-1-piperazinyl)-ethoxy)ethanol하이드록시진파모에이트(에스테르)Hydroxyzine Pamoate (500 mg)4-[[3-[2-[2-[4-[(4-Chlorophenyl)phenylmethyl]-1-piperazinyl]ethoxy]ethoxycarbonyl]-2-hydroxy-1-naphthalenyl]methyl]-3-hydroxy-2-naphthalenecarboxylic acid
이름 더 보기
2-Naphthalenecarboxylic acid, 4-[(3-carboxy-2-hydroxy-1-naphthalenyl)methyl]-3-hydroxy-, 2-[2-[2-[4-[(4-chlorophenyl)phenylmethyl]-1-piperazinyl]ethoxy]ethyl] ester
물성
구조 계산 물성
- XLogP
- 7.4
- 극성 표면적
- 120 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 14
- 무거운 원자 수
- 54
- 형식 전하
- 0
- 복잡도
- 1,190
물리화학적 성질
- 끓는 점
- 843.8 · 843.8±65.0 °C(Predicted)
- 밀도
- 1.0629 · 1.0629 (rough estimate)
- 굴절률
- 1.6 · 1.6000 (estimate)
- 산도 계수 (pKa)
- 2.98 · 2.98±0.30(Predicted)
화학 및 산업
공급사4 곳
HONEST JOY HOLDINGS LIMITED[email protected]
北京普天同创生物科技有限公司[email protected]
Whyte Chemicals[email protected]
上海甄准生物科技有限公司15800340161 · [email protected]
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