N-[4-氯-3-(三氟甲基)苯基]-N'-[[3-(4-氟苯基)-3,4-二氢-4-氧代-2-喹唑啉基]甲基]脲

更新时间：2025-12-01 10:41:12

N-[4-氯-3-(三氟甲基)苯基]-N'-[[3-(4-氟苯基)-3,4-二氢-4-氧代-2-喹唑啉基]甲基]脲结构式	常用名	N-[4-氯-3-(三氟甲基)苯基]-N'-[[3-(4-氟苯基)-3,4-二氢-4-氧代-2-喹唑啉基]甲基]脲	英文名	Hedgehog-IN-7d
	CAS号	330796-24-2	分子量	490.837
	密度	1.5±0.1 g/cm3	沸点	N/A
	分子式	C₂₃H₁₅ClF₄N₄O₂	熔点	N/A
	MSDS	N/A	闪点	N/A

用途

Hedgehog-IN-7d is a potent, cell-permeable Hedgehog (Hh) pathway inhibitor that inhibits Gli transcription activity with an IC50 value of 70 nM..

中文名	1-4-氯-3-(三氟甲基)苯基-3-3-(4-氟苯基)-4-氧代-喹唑啉-2-甲基脲
英文名	1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[[3-(4-fluorophenyl)-4-oxoquinazolin-2-yl]methyl]urea
英文别名	更多

密度	1.5±0.1 g/cm3
分子式	C₂₃H₁₅ClF₄N₄O₂
分子量	490.837
精确质量	490.081970
PSA	79.51000
LogP	5.57
InChIKey	NYOXUHUPXGFHIB-UHFFFAOYSA-N
SMILES	O=C(NCc1nc2ccccc2c(=O)n1-c1ccc(F)cc1)Nc1ccc(Cl)c(C(F)(F)F)c1
折射率	1.623

2-aminomethyl-3...

330796-23-1

3-(三氟甲基)异氰酸苯酯

329-01-1

~96%

N-[4-氯-3-(三氟甲基)...

330796-24-2

文献：Curtis, Inc. Patent: US6545005 B1, 2003 ;

2-aminomethyl-3...

330796-23-1

4-氯-3-三氟甲基异氰酸苯酯

327-78-6

~99%

N-[4-氯-3-(三氟甲基)...

330796-24-2

文献：Brunton, Shirley A.; Stibbard, John H. A.; Rubin, Lee L.; Kruse, Lawrence I.; Guicherit, Oivin M.; Boyd, Edward A.; Price, Steven Journal of Medicinal Chemistry, 2008 , vol. 51, # 5 p. 1108 - 1110

上游产品 3
CAS号330796-23-1 2-aminomethyl-3... CAS号329-01-1 3-(三氟甲基)异氰酸苯酯 CAS号327-78-6 4-氯-3-三氟甲基异氰酸苯酯
下游产品 0

实验名称：Primary qHTS assay for small molecule inhibitors of Inositol hexaphosphate kinase 1 (...
来源：NCGC
External Id：IP6K1-p1

实验名称：Primary Screen for Target Class Profiling of Small Molecule Inhibitors of Methyltrans...
来源：NCGC
External Id：MTASE-p

实验名称：Cytochrome P450 family 3 subfamily A member 4 (CYP3A4) small molecule antagonists: lu...
来源：NCGC
External Id：CYP3A4437

实验名称：Primary qHTS to identify gynecologic anti-cancer compounds using libraries of approve...
来源：NCGC
靶标：N/A
External Id：OBG420

实验名称：Cytochrome P450 family 2 subfamily D member 6 (CYP2D6) small molecule antagonists: lu...
来源：NCGC
External Id：CYP2D6395

实验名称：Cytochrome P450 family 2 subfamily C member 9 (CYP2C9) small molecule antagonists: lu...
来源：NCGC
External Id：CYP2C9536

实验名称：Primary qHTS for inhibitors of nuclear receptor binding SET domain protein 2 (NSD2) i...
来源：NCGC
External Id：NSD2-synergy-p-2C

实验名称：Primary qHTS for inhibitors of nuclear receptor binding SET domain protein 2 (NSD2) i...
来源：NCGC
External Id：NSD2-synergy-p-9B

实验名称：Viability qHTS for spleen associated tyrosine kinase inhibitor (SYKi) drug resistant ...
来源：NCGC
External Id：s-sky_synergy-MV-411_DR-CTG72-MIPE_NPC_NPACT_Kinase-p1

实验名称：Antagonist activity at Hedgehog receptor expressed in 10t1/2 cells by Gli-luciferase ...
来源：ChEMBL
靶标：N/A
External Id：CHEMBL932867

共21条，当前第1页，共3页

1-[4-Chloro-3-(trifluoromethyl)phenyl]-3-{[3-(4-fluorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]methyl}urea

N-[4-氯-3-(三氟甲基)苯基]-N'-[[3-(4-氟苯基)-3,4-二氢-4-氧代-2-喹唑啉基]甲基]脲

用途

名称

物理化学性质

合成线路

上下游产品

靶点实验

英文别名

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