3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-5-(((4-methylphenyl)sulfonyl)oxy)pyrido(2,3-d)pyrimidine-2,4,7(1H,3H,8H)-trione

HCID 59717044

기본 정보

CAS
871700-32-2
표준 SMILES
Cc1ccc(S(=O)(=O)Oc2c(C)c(=O)n(C)c3c2c(=O)n(C2CC2)c(=O)n3-c2ccc(I)cc2F)cc1
InChIKey
RCCOZJPSLZNDFV-UHFFFAOYSA-N
분자식
C25H21FIN3O6S
평균 분자량
637.4 g/mol

이름 및 식별자

우선 이름
3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-5-(((4-methylphenyl)sulfonyl)oxy)pyrido(2,3-d)pyrimidine-2,4,7(1H,3H,8H)-trione
IUPAC
[3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-2,4,7-trioxopyrido[2,3-d]pyrimidin-5-yl] 4-methylbenzenesulfonate
영어명
3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-diMethyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyriMidin-5-yl 4-Methylbenzenesulfonate
분자식
C25H21FIN3O6S
분자량
637.42

이름 및 동의어

871700-32-2HTS9D7XD8D3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-5-(((4-methylphenyl)sulfonyl)oxy)pyrido(2,3-d)pyrimidine-2,4,7(1H,3H,8H)-trione3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-5-[[(4-methylphenyl)sulfonyl]oxy]pyrido[2,3-d]pyrimidine-2,4,7(1H,3H,8H)-trioneRefChem:10676773-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl 4-methylbenzenesulfonateMFCD18207186[3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-2,4,7-trioxopyrido[2,3-d]pyrimidin-5-yl] 4-methylbenzenesulfonatePyrido[2,3-d]pyrimidine-2,4,7(1H,3H,8H)-trione, 3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-5-[[(4-methylphenyl)sulfonyl]oxy]-C25H21FIN3O6STrametinibImpurity13Trametinib Impurity 09
이름 더 보기
1044593-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-diMethyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-diMethyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyriMidin-5-yl 4-Methylbenzenesulfonate-8
SCHEMBL1419147SCHEMBL30047235RCCOZJPSLZNDFV-UHFFFAOYSA-NCS-M0423AKOS025403887CS-14284DB-241030F11737

데이터베이스 식별자

CAS
871700-32-2
PubChem CID
59717044
UNII
HTS9D7XD8D

물성

구조 계산 물성

XLogP
3.6
극성 표면적
113 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
7
회전 가능 결합 수
5
무거운 원자 수
37

물리화학적 성질

끓는 점
658 · 658.0±65.0 °C(Predicted)
밀도
1.82 · 1.82±0.1 g/cm3(Predicted)
저장 조건
2 · Storage temp. 2-8°C
산도 계수 (pKa)
-2.61 · -2.61±0.60(Predicted)

화학 및 산업

공급사35 곳

南京迪恩赛尔生物科技有限公司19951952469 · [email protected]
武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
济南德迈医药科技有限公司18669728830 15806766175 · [email protected]
NANJING YINGWEN BIOTECHNOLOGY CO LTD+86-13382787392 · [email protected]

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