891775-94-3
3-(3-BROMO-4-METHOXYPHENYL)IMIDAZO[2,1-B]THIAZOLE-6-CARBOXYLIC ACID
Name3-(3-BROMO-4-METHOXYPHENYL)IMIDAZO[2,1-B]THIAZOLE-6-CARBOXYLIC ACID
1Identification
【Name】
3-(3-BROMO-4-METHOXYPHENYL)IMIDAZO[2,1-B]THIAZOLE-6-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD05170839
【English Synonyms】
【Formula】
C13H9BrN2O3S
【MolWeight】
353.195
【Inchi】
InChI=1S/C13H9BrN2O3S/c1-19-11-3-2-7(4-8(11)14)10-6-20-13-15-9(12(17)18)5-16(10)13/h2-6H,1H3,(H,17,18)
【InChIKey】
InChIKey=IWWDOALUARCRFO-UHFFFAOYSA-N
【SMILES】
BrC=1C=C(C=CC1OC)C=1N2C(SC1)=NC(=C2)C(=O)O
【MOL File】
3-(3-BROMO-4-METHOXY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:4.1972
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(3-BROMO-4-METHOXYPHENYL)IMIDAZO[2,1-B]THIAZOLE-6-CARBOXYLIC ACID.cml