606964-49-2
3-[(4-CHLOROPHENYL)SULFONYL]-2-IMINO-10-METHYL-1-PENTYL-1,2-DIHYDRO-5H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-5-ONE
Name3-[(4-CHLOROPHENYL)SULFONYL]-2-IMINO-10-METHYL-1-PENTYL-1,2-DIHYDRO-5H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-5-ONE
pro_formulaC23 H23 Cl N4 O3 S
1Identification
【Name】
3-[(4-CHLOROPHENYL)SULFONYL]-2-IMINO-10-METHYL-1-PENTYL-1,2-DIHYDRO-5H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-5-ONE
【CAS】
【MDL】
MFCD03672273
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C23 H23 Cl N4 O3 S
【pro_molWeight】
470.979
【Inchi】
InChI=1S/C23H23ClN4O3S/c1-3-4-5-12-27-20(25)19(32(30,31)17-10-8-16(24)9-11-17)14-18-22(27)26-21-15(2)7-6-13-28(21)23(18)29/h6-11,13-14,25H,3-5,12H2,1-2H3
【InChIKey】
InChIKey=JBHDJZSGYLNUCZ-UHFFFAOYSA-N
【SMILES】
CCCCCn1c(=N)c(cc2c1nc3c(cccn3c2=O)C)S(=O)(=O)c4ccc(cc4)Cl
【MOL File】
3-[(4-CHLOROPHENYL)S….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:7
XLogP3:2.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
3-[(4-CHLOROPHENYL)SULFONYL]-2-IMINO-10-METHYL-1-PENTYL-1,2-DIHYDRO-5H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-5-ONE.cml