2-[11-(furan-2-yl)-3,3-dimethyl-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)-3,3-dimethyl-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)-3,3-dimethyl-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: | Y600-4147 |
| Compound Name: | 2-[11-(furan-2-yl)-3,3-dimethyl-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: | 485.58 |
| Molecular Formula: | C29 H31 N3 O4 |
| Smiles: | CC1(C)CC2=C(C(c3ccco3)N(CC(NCc3ccc(cc3)OC)=O)c3ccccc3N2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5925 |
| logD: | 4.5595 |
| logSw: | -4.3624 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.174 |
| InChI Key: | WRDRWIGWSHSIMM-NDEPHWFRSA-N |