220246-81-1
(R)-N-ACETYL-6-(4-AMINOPHENYL)-4,5-DIHYDRO-5-METHYL-3(2H)-PYRIDAZINONE
Name(R)-N-ACETYL-6-(4-AMINOPHENYL)-4,5-DIHYDRO-5-METHYL-3(2H)-PYRIDAZINONE
1Identification
【Name】
(R)-N-ACETYL-6-(4-AMINOPHENYL)-4,5-DIHYDRO-5-METHYL-3(2H)-PYRIDAZINONE
【CAS】
【MDL】
MFCD09952125
【English Synonyms】
【Formula】
C13 H15 N3 O2
【MolWeight】
245.281
【Inchi】
InChI=1S/C13H15N3O2/c1-8-7-12(18)15-16-13(8)10-3-5-11(6-4-10)14-9(2)17/h3-6,8H,7H2,1-2H3,(H,14,17)(H,15,18)/t8-/m1/s1
【InChIKey】
InChIKey=GDZXNMWZXLDEKG-MRVPVSSYSA-N
【SMILES】
C[C@@H]1CC(=O)NN=C1c2ccc(cc2)NC(=O)C
【MOL File】
(R)-N-ACETYL-6-(4-AM….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
(R)-N-ACETYL-6-(4-AMINOPHENYL)-4,5-DIHYDRO-5-METHYL-3(2H)-PYRIDAZINONE.cml