913835-89-9
4-[N-CYCLOPROPYL-N-(4-METHOXYBENZYL)SULFAMOYL]PHENYLBORONIC ACID
Name4-[N-CYCLOPROPYL-N-(4-METHOXYBENZYL)SULFAMOYL]PHENYLBORONIC ACID
pro_formulaC17 H20 B N O5 S
1Identification
【Name】
4-[N-CYCLOPROPYL-N-(4-METHOXYBENZYL)SULFAMOYL]PHENYLBORONIC ACID
【CAS】
【MDL】
MFCD09027226
【EnglishSynonyms】
【pro_formula】
C17 H20 B N O5 S
【pro_molWeight】
361.224
【Inchi】
InChI=1S/C17H20BNO5S/c1-24-16-8-2-13(3-9-16)12-19(15-6-7-15)25(22,23)17-10-4-14(5-11-17)18(20)21/h2-5,8-11,15,20-21H,6-7,12H2,1H3
【InChIKey】
InChIKey=BMBKRBBFPKRYSF-UHFFFAOYSA-N
【SMILES】
B(c1ccc(cc1)S(=O)(=O)N(Cc2ccc(cc2)OC)C3CC3)(O)O
【MOL File】
4-[N-CYCLOPROPYL-N-(….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:6
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
4-[N-CYCLOPROPYL-N-(4-METHOXYBENZYL)SULFAMOYL]PHENYLBORONIC ACID.cml