71435-37-5
3,5-DIHYDRO-7-METHYL-4H-PYRIMIDO[5,4-B]INDOL-4-ONE
Name3,5-DIHYDRO-7-METHYL-4H-PYRIMIDO[5,4-B]INDOL-4-ONE
1Identification
【Name】
3,5-DIHYDRO-7-METHYL-4H-PYRIMIDO[5,4-B]INDOL-4-ONE
【CAS】
【MDL】
MFCD17018615
【English Synonyms】
【Formula】
C7 H7 N3 O
【MolWeight】
149.152
【Inchi】
InChI=1S/C7H7N3O/c1-4-2-8-6-5(4)9-3-10-7(6)11/h2-3,8H,1H3,(H,9,10,11)
【InChIKey】
InChIKey=AWETXMHQKQROTA-UHFFFAOYSA-N
【SMILES】
Cc1c[nH]c2c1nc[nH]c2=O
【MOL File】
3,5-DIHYDRO-7-METHYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,5-DIHYDRO-7-METHYL-4H-PYRIMIDO[5,4-B]INDOL-4-ONE.cml