AC1MESHE
6-(2,3-dihydroxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
Also Known As: CBMicro_043196|Oprea1_260146|Oprea1_653199|BIM-0043134.P001|AB00102595-01|11-(2,3-dihydroxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one|3-(1-hydroxy-3,3-dimethyl-3,4,10,11-tetrahydro-2H-dibenzo[b,e][1,4]diazepin-11-yl)benzene-1,2-diol|10-(2,3-dihydroxyphenyl)-14,14-dimethyl-2,9-diazatricyclo[9.4.0.0(3),?]pentadeca-1(11),3(8),4,6-tetraen-12-one|3-(1-hydroxy-3,3-dimethyl-3,4,10,11-tetrahydro-2H-dibenzo[b,e][1,4]diazepin-11-yl)-1,2-benzenediol|6-(2,3-dihydroxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
| Molecular Formula | C21H22N2O3 |
|---|---|
| Molecular Weight | 350.16306 g/mol |
| LogP | 4.3197 |
| Topological Polar Surface Area | 81.59 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 350.16306 |
| Monoisotopic Mass | 350.16306 |
| Heavy Atoms | 26 |
| Complexity | 930.60345 |
Chemical Identifiers
| CAS Number | 374094-24-3 |
|---|---|
| SMILES | CC1(CC2=C(C(NC3=CC=CC=C3N2)C4=C(C(=CC=C4)O)O)C(=O)C1)C |
Product Overview
AC1MESHE (CAS 374094-24-3), with molecular formula C21H22N2O3 and molecular weight 350.16306 g/mol. IUPAC: 6-(2,3-dihydroxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one.