893612-07-2
5-BROMO-3-(3-PHENYLPIPERAZIN-1-YL)PYRAZIN-2-AMINE
Name5-BROMO-3-(3-PHENYLPIPERAZIN-1-YL)PYRAZIN-2-AMINE
1Identification
【Name】
5-BROMO-3-(3-PHENYLPIPERAZIN-1-YL)PYRAZIN-2-AMINE
【CAS】
【MDL】
MFCD08056173
【English Synonyms】
【Formula】
C14 H16 Br N5
【MolWeight】
334.219
【Inchi】
InChI=1S/C14H16BrN5/c15-12-8-18-13(16)14(19-12)20-7-6-17-11(9-20)10-4-2-1-3-5-10/h1-5,8,11,17H,6-7,9H2,(H2,16,18)
【InChIKey】
InChIKey=IQNZGGJWXBMSKX-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)C2CN(CCN2)c3c(ncc(n3)Br)N
【MOL File】
5-BROMO-3-(3-PHENYLP….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-BROMO-3-(3-PHENYLPIPERAZIN-1-YL)PYRAZIN-2-AMINE.cml