53681-01-9
1,3-DIETHYL-7-METHYL-1H-PYRROLO[2,3-D]PYRIMIDINE-2,4(3H,7H)-DIONE
Name1,3-DIETHYL-7-METHYL-1H-PYRROLO[2,3-D]PYRIMIDINE-2,4(3H,7H)-DIONE
1Identification
【Name】
1,3-DIETHYL-7-METHYL-1H-PYRROLO[2,3-D]PYRIMIDINE-2,4(3H,7H)-DIONE
【CAS】
【MDL】
MFCD01686877
【English Synonyms】
【Formula】
C11 H15 N3 O2
【MolWeight】
221.258
【Inchi】
InChI=1S/C11H15N3O2/c1-4-13-9-8(6-7-12(9)3)10(15)14(5-2)11(13)16/h6-7H,4-5H2,1-3H3
【InChIKey】
InChIKey=DSQGUESQOLYNPR-UHFFFAOYSA-N
【SMILES】
CCn1c2c(ccn2C)c(=O)n(c1=O)CC
【MOL File】
1,3-DIETHYL-7-METHYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,3-DIETHYL-7-METHYL-1H-PYRROLO[2,3-D]PYRIMIDINE-2,4(3H,7H)-DIONE.cml