AC1LUNDQ
2-[(4-amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N,N-bis(2-hydroxyethyl)acetamide
Also Known As: Oprea1_421859|Oprea1_638677|BAS 03352770|SR-01000318326-1|2-(4-amino(5,6,7,8-tetrahydrobenzo[b]thiopheno[2,3-d]pyrimidin-2-ylthio))-N,N-bis(2-hydroxyethyl)acetamide|2-[(4-amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N,N-bis(2-hydroxyethyl)acetamide|2-[(4-amino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N,N-bis(2-hydroxyethyl)acetamide|2-((4-amino-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-bis(2-hydroxyethyl)acetamide|2-(4-amino(5,6,7,8-tetrahydrobenzo[b]thiopheno[2,3-d]pyrimidin-2-ylthio))-N,N- bis(2-hydroxyethyl)acetamide
| Molecular Formula | C16H22N4O3S2 |
|---|---|
| Molecular Weight | 382.11334 g/mol |
| LogP | 1.0576 |
| Topological Polar Surface Area | 112.57 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 382.11334 |
| Monoisotopic Mass | 382.11334 |
| Heavy Atoms | 25 |
| Complexity | 759.4081 |
Chemical Identifiers
| CAS Number | 385392-71-2 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(N=C(N=C3S2)SCC(=O)N(CCO)CCO)N |
Product Overview
AC1LUNDQ (CAS 385392-71-2), with molecular formula C16H22N4O3S2 and molecular weight 382.11334 g/mol. IUPAC: 2-[(4-amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N,N-bis(2-hydroxyethyl)acetamide.
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