803744-00-5
TETRAZOLO[1,5-A]PYRIMIDINE-6-CARBOXYLIC ACID, 1,7-DIHYDRO-5-METHYL-7-(4-METHYLPHENYL)-, ETHYL ESTER
NameTETRAZOLO[1,5-A]PYRIMIDINE-6-CARBOXYLIC ACID, 1,7-DIHYDRO-5-METHYL-7-(4-METHYLPHENYL)-, ETHYL ESTER
1Identification
【Name】
TETRAZOLO[1,5-A]PYRIMIDINE-6-CARBOXYLIC ACID, 1,7-DIHYDRO-5-METHYL-7-(4-METHYLPHENYL)-, ETHYL ESTER
【CAS】
【MDL】
MFCD09752995
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C15 H17 N5 O2
【pro_molWeight】
299.332
【Inchi】
InChI=1S/C15H17N5O2/c1-4-22-14(21)12-10(3)16-15-17-18-19-20(15)13(12)11-7-5-9(2)6-8-11/h5-8,13H,4H2,1-3H3,(H,16,17,19)
【InChIKey】
InChIKey=BSLJYWFSOOMVAB-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C1=C(N=C2N=NNN2C1c3ccc(cc3)C)C
【MOL File】
TETRAZOLO[1,5-A]PYRI….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:7
XLogP3:2.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
TETRAZOLO[1,5-A]PYRIMIDINE-6-CARBOXYLIC ACID, 1,7-DIHYDRO-5-METHYL-7-(4-METHYLPHENYL)-, ETHYL ESTER.cml