1,3-dimethyl-5-[(octylamino)methyl]-1,3-dihydro-2H-benzimidazol-2-one
Chemical Structure Depiction of
1,3-dimethyl-5-[(octylamino)methyl]-1,3-dihydro-2H-benzimidazol-2-one
1,3-dimethyl-5-[(octylamino)methyl]-1,3-dihydro-2H-benzimidazol-2-one
Compound characteristics
| Compound ID: | D664-0062 |
| Compound Name: | 1,3-dimethyl-5-[(octylamino)methyl]-1,3-dihydro-2H-benzimidazol-2-one |
| Molecular Weight: | 339.91 |
| Molecular Formula: | C18 H29 N3 O |
| Salt: | HCl |
| Smiles: | [H]N(CCCCCCCC)Cc1ccc2c(c1)N(C)C(N2C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8339 |
| logD: | 0.396 |
| logSw: | -3.7115 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.8019 |
| InChI Key: | KOXCRWNOACEOOW-UHFFFAOYSA-N |