2-Methyl-N-(1-((4-(trifluoromethyl)phenyl)methyl)-1H-indazol-3-yl)-3-furancarboxamide
기본 정보
- CAS
1807454-59-6- 표준 SMILES
Cc1occc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12- InChIKey
XLLRLAABUFOJPC-UHFFFAOYSA-N- 분자식
- C21H16F3N3O2
- 평균 분자량
- 399.4 g/mol
- 단동위원소 질량
- 399.11946125
개요
NP-G2-044 is under investigation in clinical trial NCT03199586 (Phase 1 Clinical Trial of Metastasis Inhibitor NP-G2-044 in Patients With Advanced or Metastatic Solid Tumors (Including Lymphoma)).
이름 및 식별자
- 우선 이름
- 2-Methyl-N-(1-((4-(trifluoromethyl)phenyl)methyl)-1H-indazol-3-yl)-3-furancarboxamide
- IUPAC
- 2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide
- 영어명
- NP-G2-044
- 분자식
- C21H16F3N3O2
- 분자량
- 399.37
이름 및 동의어
NP-G2-0441807454-59-61ER2O3UZ4WDTXSID8011272892-Methyl-N-(1-((4-(trifluoromethyl)phenyl)methyl)-1H-indazol-3-yl)-3-furancarboxamide3-Furancarboxamide, 2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]-1H-indazol-3-yl]-3-Furancarboxamide, 2-methyl-N-(1-((4-(trifluoromethyl)phenyl)methyl)-1H-indazol-3-yl)-2-Methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]-1H-indazol-3-yl]-3-furancarboxamide2-methyl-N-(1-((4-(trifluoromethyl)phenyl)methyl)-1H-indazol-3-yl)furan-3-carboxamide2-methyl-N-(1-{[4-(trifluoromethyl)phenyl]methyl}-1H-indazol-3-yl)furan-3-carboxamideRefChem:166895Fascin Inhibitor NP-G2-044
이름 더 보기
NP-G2-044, 10 mM in DMSOinhibit,formation,filopodial,cell,NPG2044,fascin,filaments,migration,metastasis,NP G2 044,actin,NP-G-2-044,Inhibitor
DTXCID301558798NP G2 0442-Methyl-N-(1-(4-(trifluoromethyl)benzyl)-1H-indazol-3-yl)furan-3-carboxamideEX-A3988s29622-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamideAKOS040759669MS-26765
물성
구조 계산 물성
- XLogP
- 4.7
- 극성 표면적
- 60.1 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 29
- 형식 전하
- 0
- 복잡도
- 580
물리화학적 성질
- 끓는 점
- 470.5 · 470.5±45.0 °C(Predicted)
- 밀도
- 1.36 · 1.36±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 12.31 · 12.31±0.43(Predicted)
- 물리적 상태
- Solid
- 색상
- Off-white to light yellow
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…