HIT ID: HIT212668017
Cas No: 2194563-84-1
分子式: C22H33N5O6
分子量: 463.535
常用名: Methyltetrazine-PEG4-NH-Boc
氢键受体数 (HBA): 9
氢键供体数 (HBD): 1
LogP: 1.2284267
IUPAC: tert-butyl N-{2-[2-(2-{2-[4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenoxy]ethoxy}ethoxy)ethoxy]ethyl}carbamate
IUPAC: tert-butyl N-{2-[2-(2-{2-[4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenoxy]ethoxy}ethoxy)ethoxy]ethyl}carbamate
SMILES: Cc1nnc(nn1)-c1ccc(OCCOCCOCCOCCNC(=O)OC(C)(C)C)cc1
SMILES: Cc1nnc(nn1)-c1ccc(OCCOCCOCCOCCNC(=O)OC(C)(C)C)cc1
InChI key: KFLIPLCSHYXBRJ-UHFFFAOYSA-N