AC1N5TH0
N-butyl-N-ethyl-4,4-dimethyl-8-phenyl-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-amine
Also Known As: Oprea1_718779|N-BUTYL-N-(2,2-DIMETHYL-5-PHENYL-1,4-DIHYDRO-2H-PYRANO[4'',3'':4',5']PYRIDO[3',2':4,5]THIENO[3,2-D]PYRIMIDIN-8-YL)-N-ETHYLAMINE|N-butyl-N-ethyl-2,2-dimethyl-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine|N-butyl-N-ethyl-2,2-dimethyl-5-phenyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
| Molecular Formula | C26H30N4OS |
|---|---|
| Molecular Weight | 446.21402 g/mol |
| LogP | 6.3842 |
| Topological Polar Surface Area | 51.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 446.21402 |
| Monoisotopic Mass | 446.21402 |
| Heavy Atoms | 32 |
| Complexity | 1265.543 |
Chemical Identifiers
| CAS Number | 372175-91-2 |
|---|---|
| SMILES | CCCCN(CC)C1=NC=NC2=C1SC3=C2C4=C(COC(C4)(C)C)C(=N3)C5=CC=CC=C5 |
Product Overview
AC1N5TH0 (CAS 372175-91-2), with molecular formula C26H30N4OS and molecular weight 446.21402 g/mol. IUPAC: N-butyl-N-ethyl-4,4-dimethyl-8-phenyl-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-amine.