5-{[2-methoxy-4-({[(pyridin-3-yl)methyl]amino}methyl)phenoxy]methyl}-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-{[2-methoxy-4-({[(pyridin-3-yl)methyl]amino}methyl)phenoxy]methyl}-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one--hydrogen chloride (1/1)
5-{[2-methoxy-4-({[(pyridin-3-yl)methyl]amino}methyl)phenoxy]methyl}-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D300-0082 |
| Compound Name: | 5-{[2-methoxy-4-({[(pyridin-3-yl)methyl]amino}methyl)phenoxy]methyl}-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one--hydrogen chloride (1/1) |
| Molecular Weight: | 454.96 |
| Molecular Formula: | C24 H26 N4 O3 |
| Salt: | HCl |
| Smiles: | CN1C(N(C)c2cc(COc3ccc(CNCc4cccnc4)cc3OC)ccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2032 |
| logD: | 0.3091 |
| logSw: | -2.327 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.151 |
| InChI Key: | WHAFSZPUIXHYJI-UHFFFAOYSA-N |