Oprea1_384175
10-benzylsulfanyl-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one
Also Known As: Oprea1_384175|Oprea1_491936|3-allyl-2-(benzylthio)-6,7-dihydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4(5H)-one|2-(benzylsulfanyl)-3-(prop-2-en-1-yl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one|3-ALLYL-2-(BENZYLSULFANYL)-3,5,6,7-TETRAHYDRO-4H-CYCLOPENTA[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONE
| Molecular Formula | C19H18N2OS2 |
|---|---|
| Molecular Weight | 354.08606 g/mol |
| LogP | 4.425 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 354.08606 |
| Monoisotopic Mass | 354.08606 |
| Heavy Atoms | 24 |
| Complexity | 956.8975 |
Chemical Identifiers
| CAS Number | 314042-06-3 |
|---|---|
| SMILES | C=CCN1C(=O)C2=C(N=C1SCC3=CC=CC=C3)SC4=C2CCC4 |
Product Overview
Oprea1_384175 (CAS 314042-06-3), with molecular formula C19H18N2OS2 and molecular weight 354.08606 g/mol. IUPAC: 10-benzylsulfanyl-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one.
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