851169-16-9
6-AMINO-5-(2-CHLOROPROPANOYL)-3-METHYL-1-PROPYLPYRIMIDINE-2,4(1H,3H)-DIONE
Name6-AMINO-5-(2-CHLOROPROPANOYL)-3-METHYL-1-PROPYLPYRIMIDINE-2,4(1H,3H)-DIONE
1Identification
【Name】
6-AMINO-5-(2-CHLOROPROPANOYL)-3-METHYL-1-PROPYLPYRIMIDINE-2,4(1H,3H)-DIONE
【CAS】
【MDL】
MFCD06660489
【English Synonyms】
【Formula】
C11 H16 Cl N3 O3
【MolWeight】
273.718
【Inchi】
InChI=1S/C11H16ClN3O3/c1-4-5-15-9(13)7(8(16)6(2)12)10(17)14(3)11(15)18/h6H,4-5,13H2,1-3H3
【InChIKey】
InChIKey=AXLIAEFKTSQYQP-UHFFFAOYSA-N
【SMILES】
CCCn1c(c(c(=O)n(c1=O)C)C(=O)C(C)Cl)N
【MOL File】
6-AMINO-5-(2-CHLOROP….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
6-AMINO-5-(2-CHLOROPROPANOYL)-3-METHYL-1-PROPYLPYRIMIDINE-2,4(1H,3H)-DIONE.cml