1142945-82-1
2-(4-(2-(PYRROLIDIN-1-YL)ETHOXY)PHENYLAMINO)-7H-PYRROLO[2,3-D]PYRIMIDIN-4-OL
Name2-(4-(2-(PYRROLIDIN-1-YL)ETHOXY)PHENYLAMINO)-7H-PYRROLO[2,3-D]PYRIMIDIN-4-OL
1Identification
【Name】
2-(4-(2-(PYRROLIDIN-1-YL)ETHOXY)PHENYLAMINO)-7H-PYRROLO[2,3-D]PYRIMIDIN-4-OL
【CAS】
【MDL】
MFCD16877461
【English Synonyms】
【Formula】
C18 H21 N5 O2
【MolWeight】
339.397
【Inchi】
InChI=1S/C18H21N5O2/c24-17-15-7-8-19-16(15)21-18(22-17)20-13-3-5-14(6-4-13)25-12-11-23-9-1-2-10-23/h3-8H,1-2,9-12H2,(H3,19,20,21,22,24)
【InChIKey】
InChIKey=PXEKHWMLUBGCJX-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1Nc2nc3c(cc[nH]3)c(n2)O)OCCN4CCCC4
【MOL File】
2-(4-(2-(PYRROLIDIN-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:7
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(4-(2-(PYRROLIDIN-1-YL)ETHOXY)PHENYLAMINO)-7H-PYRROLO[2,3-D]PYRIMIDIN-4-OL.cml