RPR104632
HIT212673073
sdf文件结构编辑类似物检索
HIT ID: HIT212673073
Cas No: 154106-92-0
分子式: C15H11BrCl2N2O4S
分子量: 466.13
常用名: RPR104632
氢键受体数 (HBA): 5
氢键供体数 (HBD): 2
LogP: 3.9085426
IUPAC: 2-[(3-bromophenyl)methyl]-6,8-dichloro-1,1-dioxo-3,4-dihydro-2H-1lambda6,2,4-benzothiadiazine-3-carboxylic acid
IUPAC: 2-[(3-bromophenyl)methyl]-6,8-dichloro-1,1-dioxo-3,4-dihydro-2H-1lambda6,2,4-benzothiadiazine-3-carboxylic acid
SMILES: OC(=O)C1Nc2cc(Cl)cc(Cl)c2S(=O)(=O)N1Cc1cccc(Br)c1
SMILES: OC(=O)C1Nc2cc(Cl)cc(Cl)c2S(=O)(=O)N1Cc1cccc(Br)c1
InChI key: HNXXFIJGNAGRFN-UHFFFAOYSA-N
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