2-[11-(furan-2-yl)-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-N-[(4-methoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-[11-(furan-2-yl)-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-N-[(4-methoxyphenyl)methyl]acetamide
2-[11-(furan-2-yl)-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-N-[(4-methoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | J024-0083 |
| Compound Name: | 2-[11-(furan-2-yl)-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-N-[(4-methoxyphenyl)methyl]acetamide |
| Molecular Weight: | 457.53 |
| Molecular Formula: | C27 H27 N3 O4 |
| Smiles: | COc1ccc(CNC(CN2C(C3=C(CCCC3=O)Nc3ccccc23)c2ccco2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.987 |
| logD: | 3.9733 |
| logSw: | -4.2212 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.174 |
| InChI Key: | ZGDFFAFOMJIZJY-MHZLTWQESA-N |