AC1MEMW2
4-amino-12,12-dimethyl-5-[(4-nitrophenyl)methyl]-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Also Known As: Oprea1_865993|AG-690/08980023|SR-01000215752-1|3-Amino-3,5,6,8-tetrahydro-6,6-dimethyl-2-[(4-nitrophenyl)methyl]-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one|3-amino-2-{4-nitrobenzyl}-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one|3-Amino-3,5,6,8-tetrahydro-6,6-dimethyl-2-[(4-nitrophenyl)methyl]-4H-pyrano[4a(2),3a(2):4,5]thieno[2,3-d]pyrimidin-4-one|3-amino-6,6-dimethyl-2-(4-nitrobenzyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one|4-amino-12,12-dimethyl-5-[(4-nitrophenyl)methyl]-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
| Molecular Formula | C18H18N4O4S |
|---|---|
| Molecular Weight | 386.1049 g/mol |
| LogP | 2.5221 |
| Topological Polar Surface Area | 113.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 386.1049 |
| Monoisotopic Mass | 386.1049 |
| Heavy Atoms | 27 |
| Complexity | 1115.0774 |
Chemical Identifiers
| CAS Number | 400752-99-0 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)CC4=CC=C(C=C4)[N+](=O)[O-])N)C |
Product Overview
AC1MEMW2 (CAS 400752-99-0), with molecular formula C18H18N4O4S and molecular weight 386.1049 g/mol. IUPAC: 4-amino-12,12-dimethyl-5-[(4-nitrophenyl)methyl]-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one.
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