790665-09-7
2-AMINO-5,6-DIHYDRO-IMIDAZO[4,5-C]AZEPIN-4(3H)-ONE
Name2-AMINO-5,6-DIHYDRO-IMIDAZO[4,5-C]AZEPIN-4(3H)-ONE
1Identification
【Name】
2-AMINO-5,6-DIHYDRO-IMIDAZO[4,5-C]AZEPIN-4(3H)-ONE
【CAS】
【MDL】
MFCD21362592
【English Synonyms】
【Formula】
C7 H8 N4 O
【MolWeight】
164.167
【Inchi】
InChI=1S/C7H8N4O/c8-7-10-4-2-1-3-9-6(12)5(4)11-7/h1-2H,3H2,(H,9,12)(H3,8,10,11)
【InChIKey】
InChIKey=LHRYQVBHNWOMOH-UHFFFAOYSA-N
【SMILES】
C1C=Cc2c([nH]c(n2)N)C(=O)N1
【MOL File】
2-AMINO-5,6-DIHYDRO-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-AMINO-5,6-DIHYDRO-IMIDAZO[4,5-C]AZEPIN-4(3H)-ONE.cml