68587-29-1
METHYL 4,5,6,7-TETRAHYDRO-1-(PYRIDIN-2-YL)-1H-INDAZOLE-5-CARBOXYLATE
NameMETHYL 4,5,6,7-TETRAHYDRO-1-(PYRIDIN-2-YL)-1H-INDAZOLE-5-CARBOXYLATE
1Identification
【Name】
METHYL 4,5,6,7-TETRAHYDRO-1-(PYRIDIN-2-YL)-1H-INDAZOLE-5-CARBOXYLATE
【CAS】
【MDL】
MFCD11111485
【English Synonyms】
【Formula】
C14 H15 N3 O2
【MolWeight】
257.292
【Inchi】
InChI=1S/C14H15N3O2/c1-19-14(18)10-5-6-12-11(8-10)9-16-17(12)13-4-2-3-7-15-13/h2-4,7,9-10H,5-6,8H2,1H3
【InChIKey】
InChIKey=PEDNKWQOEGMIOZ-UHFFFAOYSA-N
【SMILES】
COC(=O)C1CCc2c(cnn2c3ccccn3)C1
【MOL File】
METHYL 4,5,6,7-TETRA….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
METHYL 4,5,6,7-TETRAHYDRO-1-(PYRIDIN-2-YL)-1H-INDAZOLE-5-CARBOXYLATE.cml