N-(2,4-dimethylphenyl)-4-[1-(2-methoxyethyl)-2-oxopyrrolidin-3-yl]-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-4-[1-(2-methoxyethyl)-2-oxopyrrolidin-3-yl]-1,4-diazepane-1-carboxamide
N-(2,4-dimethylphenyl)-4-[1-(2-methoxyethyl)-2-oxopyrrolidin-3-yl]-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | T991-2056 |
| Compound Name: | N-(2,4-dimethylphenyl)-4-[1-(2-methoxyethyl)-2-oxopyrrolidin-3-yl]-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 388.51 |
| Molecular Formula: | C21 H32 N4 O3 |
| Smiles: | Cc1ccc(c(C)c1)NC(N1CCCN(CC1)C1CCN(CCOC)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9314 |
| logD: | 1.6222 |
| logSw: | -2.4071 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.284 |
| InChI Key: | NYWVUKCOOOMGRI-IBGZPJMESA-N |