N-(4-ethylphenyl)-2-[1-oxo-11-(thiophen-2-yl)-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-[1-oxo-11-(thiophen-2-yl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetamide
N-(4-ethylphenyl)-2-[1-oxo-11-(thiophen-2-yl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetamide
Compound characteristics
| Compound ID: | J024-0135 |
| Compound Name: | N-(4-ethylphenyl)-2-[1-oxo-11-(thiophen-2-yl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetamide |
| Molecular Weight: | 457.59 |
| Molecular Formula: | C27 H27 N3 O2 S |
| Smiles: | CCc1ccc(cc1)NC(CN1C(C2=C(CCCC2=O)Nc2ccccc12)c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7808 |
| logD: | 5.7671 |
| logSw: | -5.396 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.748 |
| InChI Key: | SNJJQZFBFOZVRE-MHZLTWQESA-N |