4-benzyl-N,N-dimethyl-3-(3-methyl-1H-1,2,4-triazol-5-yl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-benzyl-N,N-dimethyl-3-(3-methyl-1H-1,2,4-triazol-5-yl)-1,4-diazepane-1-carboxamide
4-benzyl-N,N-dimethyl-3-(3-methyl-1H-1,2,4-triazol-5-yl)-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | SA53-0278 |
| Compound Name: | 4-benzyl-N,N-dimethyl-3-(3-methyl-1H-1,2,4-triazol-5-yl)-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 342.44 |
| Molecular Formula: | C18 H26 N6 O |
| Smiles: | Cc1nc(C2CN(CCCN2Cc2ccccc2)C(N(C)C)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5416 |
| logD: | 1.1362 |
| logSw: | -1.861 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.107 |
| InChI Key: | QYBFWRRSTTZFLJ-INIZCTEOSA-N |