11-(4-bromophenyl)-8,8-dimethyl-2,3,7,8,9,11-hexahydro[1,4]dioxino[2,3-b]acridin-10(6H)-one
Chemical Structure Depiction of
11-(4-bromophenyl)-8,8-dimethyl-2,3,7,8,9,11-hexahydro[1,4]dioxino[2,3-b]acridin-10(6H)-one
11-(4-bromophenyl)-8,8-dimethyl-2,3,7,8,9,11-hexahydro[1,4]dioxino[2,3-b]acridin-10(6H)-one
Compound characteristics
| Compound ID: | C276-0546 |
| Compound Name: | 11-(4-bromophenyl)-8,8-dimethyl-2,3,7,8,9,11-hexahydro[1,4]dioxino[2,3-b]acridin-10(6H)-one |
| Molecular Weight: | 440.34 |
| Molecular Formula: | C23 H22 Br N O3 |
| Smiles: | CC1(C)CC2=C(C(c3ccc(cc3)[Br])c3cc4c(cc3N2)OCCO4)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1546 |
| logD: | 4.0673 |
| logSw: | -4.3666 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.093 |
| InChI Key: | YHSOMHJNKIFCNX-NRFANRHFSA-N |