AC1MTQAN

4-[4-(dimethylamino)phenyl]-1-pentan-3-yl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione

Also Known As: A3758/0159332|4-(4-(dimethylamino)phenyl)-3-hydroxy-1-(pentan-3-yl)-6,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(4H)-one|4-(4-dimethylaminophenyl)-1-pentan-3-yl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione|4-[4-(DIMETHYLAMINO)PHENYL]-1-(1-ETHYLPROPYL)-3-HYDROXY-4,8-DIHYDRO-1H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-7(6H)-ONE|4-[4-(dimethylamino)phenyl]-1-(ethylpropyl)-3-hydroxy-4H,6H,8H-pyrazolo[5,4-e] 1,4-thiazepin-7-one|4-[4-(dimethylamino)phenyl]-1-pentan-3-yl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione|4-[4-(dimethylamino)phenyl]-3-hydroxy-1-(pentan-3-yl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one|4-[4-(dimethylamino)phenyl]-7-hydroxy-1-(pentan-3-yl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one

Molecular Formula	C19H26N4O2S
Molecular Weight	374.17764 g/mol
LogP	3.3782
Topological Polar Surface Area	70.13 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	374.17764
Monoisotopic Mass	374.17764
Heavy Atoms	26
Complexity	834.2143

Chemical Identifiers

CAS Number	575463-08-0
SMILES	CCC(CC)N1C2=C(C(SCC(=O)N2)C3=CC=C(C=C3)N(C)C)C(=O)N1