85633-13-2
3-PYRIDINECARBOXAMIDE, N-(4-(2-CHLOROPHENYL)-6-(1-PYRROLIDINYL)-1,3,5-TRIAZIN-2-YL)-
Name3-PYRIDINECARBOXAMIDE, N-(4-(2-CHLOROPHENYL)-6-(1-PYRROLIDINYL)-1,3,5-TRIAZIN-2-YL)-
1Identification
【Name】
3-PYRIDINECARBOXAMIDE, N-(4-(2-CHLOROPHENYL)-6-(1-PYRROLIDINYL)-1,3,5-TRIAZIN-2-YL)-
【CAS】
【MDL】
MFCD01758486
【English Synonyms】
【Formula】
C19 H17 Cl N6 O
【MolWeight】
380.837
【Inchi】
InChI=1S/C19H17ClN6O/c20-15-8-2-1-7-14(15)16-22-18(24-17(27)13-6-5-9-21-12-13)25-19(23-16)26-10-3-4-11-26/h1-2,5-9,12H,3-4,10-11H2,(H,22,23,24,25,27)
【InChIKey】
InChIKey=CPEZCIQIIAHVQJ-UHFFFAOYSA-N
【SMILES】
c1ccc(c(c1)c2nc(nc(n2)N3CCCC3)NC(=O)c4cccnc4)Cl
【MOL File】
3-PYRIDINECARBOXAMID….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-PYRIDINECARBOXAMIDE, N-(4-(2-CHLOROPHENYL)-6-(1-PYRROLIDINYL)-1,3,5-TRIAZIN-2-YL)-.cml