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Product details

名称

跨膜转运/离子通道

分子类型

小分子

英文别名

英文名称

Corr4A

货号

C668605-5mg

包装规格

5mg

CAS号

421580-53-2

分子式

C21H17ClN4O2S2

分子量

457 g/mol

PubChem编号

1144671

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC=CC=C2)C3=CSC(=N3)NC4=C(C=CC(=C4)Cl)OC

IIUPAC Name

N-[5-[2-(5-chloro-2-methoxyanilino)-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]benzamide

INCHI

1S/C21H17ClN4O2S2/c1-12-18(30-21(23-12)26-19(27)13-6-4-3-5-7-13)16-11-29-20(25-16)24-15-10-14(22)8-9-17(15)28-2/h3-11H,1-2H3,(H,24,25)(H,23,26,27)

InChi Key

RDOBOPJBMQURAT-UHFFFAOYSA-N

Smiles

CC1=C(SC(=N1)NC(=O)C2=CC=CC=C2)C3=CSC(=N3)NC4=C(C=CC(=C4)Cl)OC

PubChem CID

1144671

氢键供体数Hydrogen Bond Donor Count

氢键受体数Hydrogen Bond Acceptor Count

可旋转键计数Rotatable Bond Count

精确质量Exact Mass

456.048 Da

单同位素质量Monoisotopic Mass

456.048 Da

拓扑极表面积Topological Polar Surface Area

133.000 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

583

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

5.7

ALogP

5.7

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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