AC1METN4
2-benzoyl-9,9-dimethyl-6-thiophen-2-yl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
Also Known As: Oprea1_123845|Oprea1_247604|BAS 01832354|2-benzoyl-9,9-dimethyl-6-thiophen-2-yl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one|AG-205/14194070|SR-01000465186-1|A2316/0097710|3,3-dimethyl-7-(phenylcarbonyl)-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one|7-benzoyl-3,3-dimethyl-11-(2-thienyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one|3,3-dimethyl-7-(phenylcarbonyl)-11-(2-thienyl)-2,3,4-trihydro-5H,10H,11H-benzo [b]benzo[2,1-f]1,4-diazepin-1-one
| Molecular Formula | C26H24N2O2S |
|---|---|
| Molecular Weight | 428.15585 g/mol |
| LogP | 6.201 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 428.15585 |
| Monoisotopic Mass | 428.15585 |
| Heavy Atoms | 31 |
| Complexity | 1193.4097 |
Chemical Identifiers
| CAS Number | 332849-52-2 |
|---|---|
| SMILES | CC1(CC2=C(C(NC3=C(N2)C=C(C=C3)C(=O)C4=CC=CC=C4)C5=CC=CS5)C(=O)C1)C |
Product Overview
AC1METN4 (CAS 332849-52-2), with molecular formula C26H24N2O2S and molecular weight 428.15585 g/mol. IUPAC: 2-benzoyl-9,9-dimethyl-6-thiophen-2-yl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one.
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