955693-06-8
2-[[(4-FLUOROPHENYL)SULFONYL]AMINO]-4-METHYL-N-(3-PHENYLPROPYL)-5-THIAZOLECARBOXAMIDE
Name2-[[(4-FLUOROPHENYL)SULFONYL]AMINO]-4-METHYL-N-(3-PHENYLPROPYL)-5-THIAZOLECARBOXAMIDE
FormulaC20 H20 F N3 O3 S2
1Identification
【Name】
2-[[(4-FLUOROPHENYL)SULFONYL]AMINO]-4-METHYL-N-(3-PHENYLPROPYL)-5-THIAZOLECARBOXAMIDE
【CAS】
【MDL】
MFCD15528503
【English Synonyms】
【Formula】
C20 H20 F N3 O3 S2
【MolWeight】
433.526
【Inchi】
InChI=1S/C20H20FN3O3S2/c1-14-18(19(25)22-13-5-8-15-6-3-2-4-7-15)28-20(23-14)24-29(26,27)17-11-9-16(21)10-12-17/h2-4,6-7,9-12H,5,8,13H2,1H3,(H,22,25)(H,23,24)
【InChIKey】
InChIKey=LLXYSNPJAXPUKS-UHFFFAOYSA-N
【SMILES】
Cc1c(sc(n1)NS(=O)(=O)c2ccc(cc2)F)C(=O)NCCCc3ccccc3
【MOL File】
2-[[(4-FLUOROPHENYL)….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-[[(4-FLUOROPHENYL)SULFONYL]AMINO]-4-METHYL-N-(3-PHENYLPROPYL)-5-THIAZOLECARBOXAMIDE.cml