851879-10-2
4-CHLORO-2-THIEN-2-YL-6,7-DIHYDRO-5H-CYCLOPENTA[4,5]THIENO[2,3-D]PYRIMIDINE
Name4-CHLORO-2-THIEN-2-YL-6,7-DIHYDRO-5H-CYCLOPENTA[4,5]THIENO[2,3-D]PYRIMIDINE
1Identification
【Name】
4-CHLORO-2-THIEN-2-YL-6,7-DIHYDRO-5H-CYCLOPENTA[4,5]THIENO[2,3-D]PYRIMIDINE
【CAS】
【MDL】
MFCD06655234
【English Synonyms】
【Formula】
C13 H9 Cl N2 S2
【MolWeight】
292.813
【Inchi】
InChI=1S/C13H9ClN2S2/c14-11-10-7-3-1-4-8(7)18-13(10)16-12(15-11)9-5-2-6-17-9/h2,5-6H,1,3-4H2
【InChIKey】
InChIKey=KDXUPKMEPKGVPP-UHFFFAOYSA-N
【SMILES】
c1cc(sc1)c2nc3c(c4c(s3)CCC4)c(n2)Cl
【MOL File】
4-CHLORO-2-THIEN-2-Y….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-CHLORO-2-THIEN-2-YL-6,7-DIHYDRO-5H-CYCLOPENTA[4,5]THIENO[2,3-D]PYRIMIDINE.cml