AC1O0S6B

1-[5-methyl-7-(3-nitrophenyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethanone

Also Known As: SR-01000444516-1|F0497-0062|1-(5-methyl-7-(3-nitrophenyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone|1-[5-methyl-7-(3-nitrophenyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethan-1-one|1-[5-methyl-7-(3-nitrophenyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethanone|1-[5-methyl-7-(3-nitrophenyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethanone|1-[5-METHYL-7-(3-NITROPHENYL)-4,7-DIHYDRO[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-6-YL]-1-ETHANONE

Molecular Formula	C14H13N5O3
Molecular Weight	299.10184 g/mol
LogP	2.0642
Topological Polar Surface Area	102.95 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	3
Exact Mass	299.10184
Monoisotopic Mass	299.10184
Heavy Atoms	22
Complexity	808.3146

Chemical Identifiers

CAS Number	329795-96-2
SMILES	CC1=C(C(N2C(=NC=N2)N1)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C