7-(cyclohexylmethyl)-2-methyl-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one
Chemical Structure Depiction of
7-(cyclohexylmethyl)-2-methyl-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one
7-(cyclohexylmethyl)-2-methyl-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one
Compound characteristics
| Compound ID: | S636-0851 |
| Compound Name: | 7-(cyclohexylmethyl)-2-methyl-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one |
| Molecular Weight: | 264.37 |
| Molecular Formula: | C14 H24 N4 O |
| Smiles: | CN1C(N2CCN(CCC2=N1)CC1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2952 |
| logD: | 0.6192 |
| logSw: | -1.9983 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.199 |
| InChI Key: | ARQRFDMXOVZGKX-UHFFFAOYSA-N |