AC1MW1NV
N',N'-dimethyl-N-[7-(2-methylpropyl)-14-methylsulfanyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl]ethane-1,2-diamine
Also Known As: N,N-dimethyl-N'-[4-(2-methylpropyl)-9-(methylsulfanyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]ethane-1,2-diamine|N1-(4-isobutyl-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)-N2,N2-dimethylethane-1,2-diamine
| Molecular Formula | C21H29N5S2 |
|---|---|
| Molecular Weight | 415.18643 g/mol |
| LogP | 4.6221 |
| Topological Polar Surface Area | 53.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 415.18643 |
| Monoisotopic Mass | 415.18643 |
| Heavy Atoms | 28 |
| Complexity | 1009.35254 |
Chemical Identifiers
| CAS Number | 577762-59-5 |
|---|---|
| SMILES | CC(C)CC1=NC2=C(C3=C1CCC3)C4=C(S2)C(=NC(=N4)SC)NCCN(C)C |
Product Overview
AC1MW1NV (CAS 577762-59-5), with molecular formula C21H29N5S2 and molecular weight 415.18643 g/mol. IUPAC: N',N'-dimethyl-N-[7-(2-methylpropyl)-14-methylsulfanyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl]ethane-1,2-diamine.