기본 정보
- CAS
12712-32-2- 표준 SMILES
C1CN(P2(N3CC3)=NP(N3CC3)(N3CC3)=NP(N3CC3)(N3CC3)=N2)CCO1- InChIKey
SCGZIPCHOAVGCL-UHFFFAOYSA-N- 분자식
- C14H28N9OP3
- 평균 분자량
- 431.35 g/mol
- 단동위원소 질량
- 431.16296754
개요
Fotretamine is a pentaethyleneimine derivative with antineoplastic alkylating activity. Fotretamine causes chromosomal breaks in lymphocytes which contributes to its immunosuppressive activity.
이름 및 식별자
- 우선 이름
- Fotretamine
- IUPAC
- 4-[2,4,4,6,6-pentakis(aziridin-1-yl)-1,3,5-triaza-2λ5,4λ5,6λ5-triphosphacyclohexa-1,3,5-trien-2-yl]morpholine
- 현지명
- 포트레타민
- 영어명
- Fotretamine
- 분자식
- C14H28N9OP3
- 분자량
- 431.359
이름 및 동의어
FotretamineFotrin37132-72-2FotretaminaPhotrinFotretaminumDTXSID5048687NSC-216135NSC2161357Z7670589CDTXCID50286132,2,4,4,6-pentaethyleneimino-6-morpholinocyclotriphosphazatriene
이름 더 보기
포트레타민2λ5,4λ5,6λ5-1,3,5,2,4,6-Triazatriphosphorine, 2,2,4,4,6-pentakis(1-aziridinyl)-6-(4-morpholinyl)-1,3,5,2,4,6-Triazatriphosphorine, 2,2,4,4,6-pentakis(1-aziridinyl)-2,2,4,4,6,6-hexahydro-6-(4-morpholinyl)-
2,2,4,4,6-Pentaethylenimino-6-morpholino-cyclotriphosphazatrien2,2,4,4,6-Pentakis(1-aziridinyl)-2,2,4,4,6,6-hexahydro-6-(4-morpholinyl)-1,3, 5,2,4,6-triazatriphosphorineRefChem:141404PhotrinumFortrinFotretamine [INN]PhotrineMonomorpholine, pentaethyleneiminotriphosphonitrile
데이터베이스 식별자
- CAS
12712-32-2、37132-72-2- PubChem CID
- 65800
- DTXSID
DTXSID5048687- ChEMBL
CHEMBL471525- UNII
- 7Z7670589C
물성
구조 계산 물성
- XLogP
- 0.5
- 극성 표면적
- 64.6 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 27
- 형식 전하
- 0
- 복잡도
- 751
물리화학적 성질
- 녹는점
- 121 °C · 121°C
- 밀도
- 2.1 · 2.10±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 3.66 · 3.66±0.50(Predicted)
- 물리적 상태
- 고체
화학 및 산업
약리 정보
MeSH Pharmacological Classification
Chemical agents that increase the rate of genetic mutation by interfering with the function of nucleic acids. A clastogen is a specific mutagen that causes breaks in chromosomes.
A class of drugs that differs from other alkylating agents used clinically in that they are monofunctional and thus unable to cross-link cellular macromolecules. Among their common properties are a requirement for metabolic activation to intermediates with antitumor efficacy and the presence in their chemical structures of N-methyl groups, that after metabolism, can covalently modify cellular DNA. The precise mechanisms by which each of these drugs acts to kill tumor cells are not completely understood. (From AMA, Drug Evaluations Annual, 1994, p2026)
공급사1 곳
Lanospharma Laboratories Co.,Ltd13440048448 · [email protected]
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