AC1MG2HQ
N-[2-(4-methoxyphenyl)ethyl]-2-[(7-methyl-4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Also Known As: Oprea1_844673|AF-399/40827737|N-[2-(4-methoxyphenyl)ethyl]-2-[(7-methyl-4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide|2-[(3-allyl-7-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[2-(4-methoxyphenyl)ethyl]acetamide|N-[2-(4-methoxyphenyl)ethyl]-2-(7-methyl-4-oxo-3-prop-2-enyl(3,5,6,7,8-pentahy drobenzo[b]thiopheno[2,3-d]pyrimidin-2-ylthio))acetamide
| Molecular Formula | C25H29N3O3S2 |
|---|---|
| Molecular Weight | 483.16504 g/mol |
| LogP | 4.2284 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 483.16504 |
| Monoisotopic Mass | 483.16504 |
| Heavy Atoms | 33 |
| Complexity | 1214.3456 |
Chemical Identifiers
| CAS Number | 379237-19-1 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)NCCC4=CC=C(C=C4)OC)CC=C |
Product Overview
AC1MG2HQ (CAS 379237-19-1), with molecular formula C25H29N3O3S2 and molecular weight 483.16504 g/mol. IUPAC: N-[2-(4-methoxyphenyl)ethyl]-2-[(7-methyl-4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide.
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