896468-39-6
3,5-DIHYDRO-7-(1-PYRROLIDINYLMETHYL)-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONE
Name3,5-DIHYDRO-7-(1-PYRROLIDINYLMETHYL)-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONE
1Identification
【Name】
3,5-DIHYDRO-7-(1-PYRROLIDINYLMETHYL)-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONE
【CAS】
【MDL】
MFCD17013891
【English Synonyms】
【Formula】
C11 H14 N4 O
【MolWeight】
218.259
【Inchi】
InChI=1S/C11H14N4O/c16-11-10-9(13-7-14-11)8(5-12-10)6-15-3-1-2-4-15/h5,7,12H,1-4,6H2,(H,13,14,16)
【InChIKey】
InChIKey=NUWMTSMNSJQIHT-UHFFFAOYSA-N
【SMILES】
c1c(c2c([nH]1)c(=O)[nH]cn2)CN3CCCC3
【MOL File】
3,5-DIHYDRO-7-(1-PYR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,5-DIHYDRO-7-(1-PYRROLIDINYLMETHYL)-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONE.cml