5-[(4-{[(butan-2-yl)amino]methyl}-2-methoxyphenoxy)methyl]-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-[(4-{[(butan-2-yl)amino]methyl}-2-methoxyphenoxy)methyl]-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one--hydrogen chloride (1/1)
5-[(4-{[(butan-2-yl)amino]methyl}-2-methoxyphenoxy)methyl]-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D300-0096 |
| Compound Name: | 5-[(4-{[(butan-2-yl)amino]methyl}-2-methoxyphenoxy)methyl]-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one--hydrogen chloride (1/1) |
| Molecular Weight: | 419.95 |
| Molecular Formula: | C22 H29 N3 O3 |
| Salt: | HCl |
| Smiles: | CCC(C)NCc1ccc(c(c1)OC)OCc1ccc2c(c1)N(C)C(N2C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8628 |
| logD: | -1.1906 |
| logSw: | -3.3633 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.137 |
| InChI Key: | HVKYLEPXPKZWLP-HNNXBMFYSA-N |