5-(2-ethylbutanoyl)-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Chemical Structure Depiction of
5-(2-ethylbutanoyl)-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
5-(2-ethylbutanoyl)-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Compound characteristics
| Compound ID: | D479-0147 |
| Compound Name: | 5-(2-ethylbutanoyl)-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one |
| Molecular Weight: | 274.36 |
| Molecular Formula: | C16 H22 N2 O2 |
| Smiles: | CCC(CC)C(N1CC(C)C(Nc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0117 |
| logD: | 2.9596 |
| logSw: | -3.2363 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.044 |
| InChI Key: | IIXRJUAAJOUOHH-NSHDSACASA-N |