851207-81-3
4-CHLORO-2-THIEN-2-YL-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDINE
Name4-CHLORO-2-THIEN-2-YL-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDINE
1Identification
【Name】
4-CHLORO-2-THIEN-2-YL-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDINE
【CAS】
【MDL】
MFCD06375931
【English Synonyms】
【Formula】
C14 H11 Cl N2 S2
【MolWeight】
306.84
【Inchi】
InChI=1S/C14H11ClN2S2/c15-12-11-8-4-1-2-5-9(8)19-14(11)17-13(16-12)10-6-3-7-18-10/h3,6-7H,1-2,4-5H2
【InChIKey】
InChIKey=QPHQPWXSEMEKRL-UHFFFAOYSA-N
【SMILES】
c1cc(sc1)c2nc3c(c4c(s3)CCCC4)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
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-CHLORO-2-THIEN-2-YL-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDINE.cml