HCID11278274

5-(Benzylthio)-7-chloro[1,3]thiazolo[4,5-d]pyrimidin-2-amine

5-benzylsulfanyl-7-chloro-[1,3]thiazolo[4,5-d]pyrimidin-2-amine

C12H9ClN4S2308.8 g/mol

查看相关反应子结构检索查找相似结构

IDENTITY

结构与身份

标准SMILES: Nc1nc2nc(SCc3ccccc3)nc(Cl)c2s1
InChIKey: SJNSPSXSWUZBQZ-UHFFFAOYSA-N
分子式: C12H9ClN4S2
平均分子量: 308.8 g/mol
单同位素质量: 307.9957163

COMPUTED

结构计算性质

已同步

XLogP: 3.9
极性表面积: 118 Å²
氢键供体: 1
氢键受体: 6
可旋转键: 3
重原子: 19
形式电荷: 0
复杂度: 303

ALIASES

名称与别名

共 12 条

5-(Benzylthio)-7-chloro[1,3]thiazolo[4,5-d]pyrimidin-2-amineCHEMBL383421259103-38-3SCHEMBL212610SJNSPSXSWUZBQZ-UHFFFAOYSA-NBDBM50537680DB-316928F707155-phenylmethylthio-7-chloro-thiazolo[4,5-d]pyrimidin-2-ylamin5-Phenylmethylthio-7-chloro-thiazolo[4,5-d]pyrimidin-2-ylamine5-benzylsulfanyl-7-chloro-[1,3]thiazolo[4,5-d]pyrimidin-2-amine7-Chloro-5-[(phenylmethyl)thio]thiazolo[4,5-d]pyrimidin-2-amine

REACTIONS

相关反应

34 条

uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09440992B2

查看

uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09440992B2

查看

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

查看

Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

查看

Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

查看

Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

查看

Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

查看

uspto-grants-2012_01 · 10.6084/m9.figshare.5104873.v1 · US08088780B2

查看