AC1NELES

4-(2,4-dichlorophenyl)-1-propan-2-yl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione

Also Known As: 4-(2,4-dichlorophenyl)-1-propan-2-yl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione|4-(2,4-dichlorophenyl)-3-hydroxy-1-(propan-2-yl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one|4-(2,4-dichlorophenyl)-3-hydroxy-1-isopropyl-6,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(4H)-one|4-(2,4-dichlorophenyl)-7-hydroxy-1-(propan-2-yl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one

Molecular Formula	C15H15Cl2N3O2S
Molecular Weight	371.0262 g/mol
LogP	3.8388
Topological Polar Surface Area	66.89 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	2
Exact Mass	371.0262
Monoisotopic Mass	371.0262
Heavy Atoms	23
Complexity	828.61487

Chemical Identifiers

CAS Number	797797-85-4
SMILES	CC(C)N1C2=C(C(SCC(=O)N2)C3=C(C=C(C=C3)Cl)Cl)C(=O)N1