N-(4-ethylphenyl)-2-[11-(furan-2-yl)-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetamide
Chemical Structure Depiction of
N-(4-ethylphenyl)-2-[11-(furan-2-yl)-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetamide
N-(4-ethylphenyl)-2-[11-(furan-2-yl)-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetamide
Compound characteristics
| Compound ID: | J024-0101 |
| Compound Name: | N-(4-ethylphenyl)-2-[11-(furan-2-yl)-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetamide |
| Molecular Weight: | 441.53 |
| Molecular Formula: | C27 H27 N3 O3 |
| Smiles: | CCc1ccc(cc1)NC(CN1C(C2=C(CCCC2=O)Nc2ccccc12)c1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3575 |
| logD: | 5.3438 |
| logSw: | -5.2383 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.308 |
| InChI Key: | XFARLUOGFIBODQ-MHZLTWQESA-N |