AC1MXRI3

2-[(4,4-dimethyl-8-pyrrolidin-1-yl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-yl)-methylamino]ethanol

Also Known As: 2-((2,2-dimethyl-5-(pyrrolidin-1-yl)-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)(methyl)amino)ethanol|2-{[2,2-dimethyl-5-(pyrrolidin-1-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl](methyl)amino}ethanol

Molecular Formula	C21H27N5O2S
Molecular Weight	413.18854 g/mol
LogP	3.1195
Topological Polar Surface Area	74.61 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	8
Rotatable Bonds	4
Exact Mass	413.18854
Monoisotopic Mass	413.18854
Heavy Atoms	29
Complexity	1074.0448

Chemical Identifiers

CAS Number	844463-95-2
SMILES	CC1(CC2=C(CO1)C(=NC3=C2C4=C(S3)C(=NC=N4)N(C)CCO)N5CCCC5)C