477852-31-6
2-(BENZYLSULFONYL)-4-METHYL-6,7-DIHYDRO-5H-CYCLOPENTA(D)PYRIMIDINE
Name2-(BENZYLSULFONYL)-4-METHYL-6,7-DIHYDRO-5H-CYCLOPENTA(D)PYRIMIDINE
1Identification
【Name】
2-(BENZYLSULFONYL)-4-METHYL-6,7-DIHYDRO-5H-CYCLOPENTA(D)PYRIMIDINE
【CAS】
【MDL】
MFCD00139341
【English Synonyms】
【Formula】
C15 H16 N2 O2 S
【MolWeight】
288.369
【Inchi】
InChI=1S/C15H16N2O2S/c1-11-13-8-5-9-14(13)17-15(16-11)20(18,19)10-12-6-3-2-4-7-12/h2-4,6-7H,5,8-10H2,1H3
【InChIKey】
InChIKey=AFZNBSKVEAVOPS-UHFFFAOYSA-N
【SMILES】
Cc1c2c(nc(n1)S(=O)(=O)Cc3ccccc3)CCC2
【MOL File】
2-(BENZYLSULFONYL)-4….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(BENZYLSULFONYL)-4-METHYL-6,7-DIHYDRO-5H-CYCLOPENTA(D)PYRIMIDINE.cml