1-bromo-5,11,11,11a-tetramethyl-6,7,11,11a-tetrahydro-4H,9H-[1,3]oxazolo[3',4':1,2]azepino[5,4,3-cd]indol-9-one
Chemical Structure Depiction of
1-bromo-5,11,11,11a-tetramethyl-6,7,11,11a-tetrahydro-4H,9H-[1,3]oxazolo[3',4':1,2]azepino[5,4,3-cd]indol-9-one
1-bromo-5,11,11,11a-tetramethyl-6,7,11,11a-tetrahydro-4H,9H-[1,3]oxazolo[3',4':1,2]azepino[5,4,3-cd]indol-9-one
Compound characteristics
| Compound ID: | 8012-7628 |
| Compound Name: | 1-bromo-5,11,11,11a-tetramethyl-6,7,11,11a-tetrahydro-4H,9H-[1,3]oxazolo[3',4':1,2]azepino[5,4,3-cd]indol-9-one |
| Molecular Weight: | 363.25 |
| Molecular Formula: | C17 H19 Br N2 O2 |
| Smiles: | Cc1c2CCN3C(=O)OC(C)(C)C3(C)c3c(ccc(c23)[nH]1)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2694 |
| logD: | 4.2694 |
| logSw: | -4.6915 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.898 |
| InChI Key: | BEUNIKGKKZYPHG-QGZVFWFLSA-N |