N-cyclohexyl-4-(2-methylpropanoyl)-3-(3-methyl-1H-1,2,4-triazol-5-yl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-cyclohexyl-4-(2-methylpropanoyl)-3-(3-methyl-1H-1,2,4-triazol-5-yl)-1,4-diazepane-1-carboxamide
N-cyclohexyl-4-(2-methylpropanoyl)-3-(3-methyl-1H-1,2,4-triazol-5-yl)-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | SA53-1290 |
| Compound Name: | N-cyclohexyl-4-(2-methylpropanoyl)-3-(3-methyl-1H-1,2,4-triazol-5-yl)-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 376.5 |
| Molecular Formula: | C19 H32 N6 O2 |
| Smiles: | CC(C)C(N1CCCN(CC1c1nc(C)n[nH]1)C(NC1CCCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2261 |
| logD: | 2.2254 |
| logSw: | -2.3226 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.839 |
| InChI Key: | SEEMCSBSWPTHQO-INIZCTEOSA-N |