AC1LO4SC
13-(1H-benzimidazol-2-ylmethylsulfanyl)-4,4-dimethyl-8-morpholin-4-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-hexaene
Also Known As: CBKinase1_011528|CBKinase1_023928|BRD-K21191551-001-01-8|8-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-2,2-dimethyl-5-morpholino-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine|8-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
| Molecular Formula | C26H26N6O2S2 |
|---|---|
| Molecular Weight | 518.1559 g/mol |
| LogP | 5.096 |
| Topological Polar Surface Area | 89.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 518.1559 |
| Monoisotopic Mass | 518.1559 |
| Heavy Atoms | 36 |
| Complexity | 1571.955 |
Chemical Identifiers
| CAS Number | 799802-35-0 |
|---|---|
| SMILES | CC1(CC2=C(CO1)C(=NC3=C2C4=C(S3)C(=NC=N4)SCC5=NC6=CC=CC=C6N5)N7CCOCC7)C |
Product Overview
AC1LO4SC (CAS 799802-35-0), with molecular formula C26H26N6O2S2 and molecular weight 518.1559 g/mol. IUPAC: 13-(1H-benzimidazol-2-ylmethylsulfanyl)-4,4-dimethyl-8-morpholin-4-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-hexaene.
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