71483-23-3
4-[(6-CHLORO-4,7-DIMETHYL-7H-PYRROLO[2,3-D]PYRIMIDIN-2-YL)METHYL]PHENYL METHYL ETHER
Name4-[(6-CHLORO-4,7-DIMETHYL-7H-PYRROLO[2,3-D]PYRIMIDIN-2-YL)METHYL]PHENYL METHYL ETHER
pro_formulaC16 H16 Cl N3 O
1Identification
【Name】
4-[(6-CHLORO-4,7-DIMETHYL-7H-PYRROLO[2,3-D]PYRIMIDIN-2-YL)METHYL]PHENYL METHYL ETHER
【CAS】
【MDL】
MFCD08361720
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C16 H16 Cl N3 O
【pro_molWeight】
301.775
【Inchi】
InChI=1S/C16H16ClN3O/c1-10-13-9-14(17)20(2)16(13)19-15(18-10)8-11-4-6-12(21-3)7-5-11/h4-7,9H,8H2,1-3H3
【InChIKey】
InChIKey=NGHRXKLHZQQUDU-UHFFFAOYSA-N
【SMILES】
Cc1c2cc(n(c2nc(n1)Cc3ccc(cc3)OC)C)Cl
【MOL File】
4-[(6-CHLORO-4,7-DIM….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:4
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
4-[(6-CHLORO-4,7-DIMETHYL-7H-PYRROLO[2,3-D]PYRIMIDIN-2-YL)METHYL]PHENYL METHYL ETHER.cml