500557-04-0
BENZAMIDE, 3-AMINO-N-(1S,2R,4R)-7-AZABICYCLO[2.2.1]HEPT-2-YL-4-HYDROXY-
NameBENZAMIDE, 3-AMINO-N-(1S,2R,4R)-7-AZABICYCLO[2.2.1]HEPT-2-YL-4-HYDROXY-
1Identification
【Name】
BENZAMIDE, 3-AMINO-N-(1S,2R,4R)-7-AZABICYCLO[2.2.1]HEPT-2-YL-4-HYDROXY-
【CAS】
【MDL】
MFCD19705236
【English Synonyms】
【Formula】
C13 H17 N3 O2
【MolWeight】
247.296
【Inchi】
InChI=1S/C13H17N3O2/c14-9-5-7(1-4-12(9)17)13(18)16-11-6-8-2-3-10(11)15-8/h1,4-5,8,10-11,15,17H,2-3,6,14H2,(H,16,18)/t8-,10+,11-/m1/s1
【InChIKey】
InChIKey=LJSXLBOWXISZSL-DVVUODLYSA-N
【SMILES】
c1cc(c(cc1C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3)N)O
【MOL File】
BENZAMIDE, 3-AMINO-N….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:4
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
BENZAMIDE, 3-AMINO-N-(1S,2R,4R)-7-AZABICYCLO[2.2.1]HEPT-2-YL-4-HYDROXY-.cml