기본 정보
- CAS
1374639-75-4- 표준 SMILES
CN(C)C(=O)c1cc2cnc(Nc3ccc(N4CCNCC4)cn3)nc2n1C1CCCC1.O=C(O)CCC(=O)O- InChIKey
NHANOMFABJQAAH-UHFFFAOYSA-N- 분자식
- C27H36N8O5
- 평균 분자량
- 552.6 g/mol
- 단동위원소 질량
- 552.28086628
개요
Ribociclib Succinate is the succinate salt form of ribociclib, an orally available inhibitor of the cyclin-dependent kinases (CDKs) 4 and 6, with antineoplastic activity. Upon oral administration, ribociclib specifically targets, binds to and inhibits CDK4 and CDK6. This inhibits the cyclin D1/CDK4 and cyclin D3/CDK6 cell cycle pathway, which inhibits phosphorylation of the retinoblastoma (Rb) protein. Inhibition of Rb phosphorylation prevents CDK-mediated G1-S phase transition, thereby arresting the cell cycle in the G1 phase, suppressing DNA synthesis and inhibiting cancer cell growth. Overexpression of CDK4/6, as seen in certain types of cancer, causes cell cycle dysregulation.
이름 및 식별자
- 우선 이름
- Ribociclib Succinate
- IUPAC
- butanedioic acid;7-cyclopentyl-N,N-dimethyl-2-[(5-piperazin-1-yl-2-pyridinyl)amino]pyrrolo[2,3-d]pyrimidine-6-carboxamide
- 현지명
- LEE011(숙시네이트수화물)
- 영어명
- LEE011 (succinate hydrate)
- 분자식
- C27H36N8O5
- 분자량
- 552.64
이름 및 동의어
Ribociclib succinate1374639-75-4LEE-011 succinateLEE011-BBABirociclibUNII-BG7HLX2919LEE-011-BBABG7HLX2919KISQALI FEMARA CO-PACK COMPONENT RIBOCICLIB SUCCINATERefChem:55977RIBOCICLIB SUCCINATE COMPONENT OF KISQALI FEMARA CO-PACKLEE011 succinate
이름 더 보기
LEE011(숙시네이트수화물)Ribociclib succite hydrateLEE011 (succinate hydrate)Ribociclib Succinate hydratRibociclib (succinate hydrate)Ribociclib (LEE011) succinate hydrateRIBOCICLIB SUCCINATE HYDRATE (LEE011 SUCCINATE HYDRATE)
7-Cyclopentyl-N,N-dimethyl-2-((5-(piperazin-1-yl)pyridin-2-yl)amino)-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide succinateRibociclib succinate [USAN]KisqaliMFCD28167746butanedioic acid;7-cyclopentyl-N,N-dimethyl-2-[(5-piperazin-1-ylpyridin-2-yl)amino]pyrrolo[2,3-d]pyrimidine-6-carboxamideRibociclib succinate (USAN)7-cyclopentyl-N,N-dimethyl-2-{[5-(piperazin-1-yl)pyridin-2-yl]amino}-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide; butanedioic acid7-cyclopentyl-N,N-dimethyl-2-((5-(piperazin-1-yl)pyridin-2-yl)amino)-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide succinic acid
물성
구조 계산 물성
- 극성 표면적
- 166 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 11
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 40
- 형식 전하
- 0
- 복잡도
- 728
실험 및 물리화학적 성질
Human Drugs
FDA approved drugs -> Active ingredient
EMA approved medicines: Human medicine
FDA approved drugs -> Active ingredient
물리화학적 성질
- 저장 조건
- -20 °C · Store at -20°C
- 용해도
- 19 mg/mL · DMSO: ≥ 19 mg/mL (33.30 mM)
- 물리적 상태
- 가루
- 색상
- White to yellow
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]
P203, P260, P264, P264+P265, P270, P273, P280, P301+P316, P302+P352, P305+P351+P338, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 3 (50%)
독성 정보
Drug Induced Liver Injury
Drug Induced Liver Injury Rank (DILIrank 2.0)
Ribociclib succinate
vMost-DILI-concern
4
Warnings & precautions
DOI:10.1016/j.drudis.2016.02.015
화학 및 산업
공급사33 곳
BEIJING SJAR TECHNOLOGY DEVELOPMENT CO., LTD.+86-18600796368 · [email protected]
United Life Science020-82099279 18988968278 · [email protected]
InvivoChem中国13549236410 · [email protected]
銳迪國際科技有限公司18024082417 · [email protected]
常州市华阳科技有限公司+8615250961469 · [email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
苏州卡普维尔医药科技有限公司0512-0512-88981216 13776013740 · [email protected]
上海喀露蓝科技有限公司18149758185 18149758185 · [email protected]
四川省维克奇生物科技有限公司028-81700200 18116577057 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
斯派螺（武汉）药物研发有限公司[email protected]
挪亚泰尔医药科技(上海)有限公司4008215138 15216673995 · [email protected]
BOC Sciences16314854226 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…