886503-05-5
7-(3,4-DIMETHOXYPHENYL)PYRAZOLO[1,5-A]PYRIMIDINE-2-CARBOXYLIC ACID
Name7-(3,4-DIMETHOXYPHENYL)PYRAZOLO[1,5-A]PYRIMIDINE-2-CARBOXYLIC ACID
1Identification
【Name】
7-(3,4-DIMETHOXYPHENYL)PYRAZOLO[1,5-A]PYRIMIDINE-2-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD06739362
【English Synonyms】
【Formula】
C15 H13 N3 O4
【MolWeight】
299.285
【Inchi】
InChI=1S/C15H13N3O4/c1-21-12-4-3-9(7-13(12)22-2)11-5-6-16-14-8-10(15(19)20)17-18(11)14/h3-8H,1-2H3,(H,19,20)
【InChIKey】
InChIKey=XHJFJCDSODRMRL-UHFFFAOYSA-N
【SMILES】
COc1ccc(cc1OC)c2ccnc3n2nc(c3)C(=O)O
【MOL File】
7-(3,4-DIMETHOXYPHEN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
7-(3,4-DIMETHOXYPHENYL)PYRAZOLO[1,5-A]PYRIMIDINE-2-CARBOXYLIC ACID.cml