1-[7-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(1-methyl-1H-pyrrole-2-carbonyl)-1,4-diazepan-1-yl]ethan-1-one
Chemical Structure Depiction of
1-[7-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(1-methyl-1H-pyrrole-2-carbonyl)-1,4-diazepan-1-yl]ethan-1-one
1-[7-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(1-methyl-1H-pyrrole-2-carbonyl)-1,4-diazepan-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | S990-0579 |
| Compound Name: | 1-[7-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(1-methyl-1H-pyrrole-2-carbonyl)-1,4-diazepan-1-yl]ethan-1-one |
| Molecular Weight: | 331.37 |
| Molecular Formula: | C16 H21 N5 O3 |
| Smiles: | CC(N1CCN(CCC1c1nc(C)no1)C(c1cccn1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0783 |
| logD: | 1.0783 |
| logSw: | -1.6286 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.814 |
| InChI Key: | ISEOUJRKQAOROS-CYBMUJFWSA-N |