237435-11-9
3,5-DIHYDRO-2-METHYL-6-(4-METHYLPHENYL)-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONE
Name3,5-DIHYDRO-2-METHYL-6-(4-METHYLPHENYL)-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONE
1Identification
【Name】
3,5-DIHYDRO-2-METHYL-6-(4-METHYLPHENYL)-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONE
【CAS】
【MDL】
MFCD17018618
【English Synonyms】
【Formula】
C14 H13 N3 O
【MolWeight】
239.277
【Inchi】
InChI=1S/C14H13N3O/c1-8-3-5-10(6-4-8)11-7-12-13(17-11)14(18)16-9(2)15-12/h3-7,17H,1-2H3,(H,15,16,18)
【InChIKey】
InChIKey=ZITNQUUKWMPFFC-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)c2cc3c([nH]2)c(=O)[nH]c(n3)C
【MOL File】
3,5-DIHYDRO-2-METHYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,5-DIHYDRO-2-METHYL-6-(4-METHYLPHENYL)-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONE.cml