1251023-44-5
3-(PYRIDIN-4-YL)-6,7-DIHYDRO-5H-PYRROLO[2,1-C][1,2,4]TRIAZOLE-5-CARBOXAMIDE
Name3-(PYRIDIN-4-YL)-6,7-DIHYDRO-5H-PYRROLO[2,1-C][1,2,4]TRIAZOLE-5-CARBOXAMIDE
1Identification
【Name】
3-(PYRIDIN-4-YL)-6,7-DIHYDRO-5H-PYRROLO[2,1-C][1,2,4]TRIAZOLE-5-CARBOXAMIDE
【CAS】
【MDL】
MFCD16877235
【English Synonyms】
【Formula】
C11 H11 N5 O
【MolWeight】
229.242
【Inchi】
InChI=1S/C11H11N5O/c12-10(17)8-1-2-9-14-15-11(16(8)9)7-3-5-13-6-4-7/h3-6,8H,1-2H2,(H2,12,17)
【InChIKey】
InChIKey=WSSFRHVTBCRLIL-UHFFFAOYSA-N
【SMILES】
c1cnccc1c2nnc3n2C(CC3)C(=O)N
【MOL File】
3-(PYRIDIN-4-YL)-6,7….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(PYRIDIN-4-YL)-6,7-DIHYDRO-5H-PYRROLO[2,1-C][1,2,4]TRIAZOLE-5-CARBOXAMIDE.cml