5-[(2-methoxy-4-{[(prop-2-en-1-yl)amino]methyl}phenoxy)methyl]-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one
Chemical Structure Depiction of
5-[(2-methoxy-4-{[(prop-2-en-1-yl)amino]methyl}phenoxy)methyl]-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one
5-[(2-methoxy-4-{[(prop-2-en-1-yl)amino]methyl}phenoxy)methyl]-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one
Compound characteristics
| Compound ID: | D300-0098 |
| Compound Name: | 5-[(2-methoxy-4-{[(prop-2-en-1-yl)amino]methyl}phenoxy)methyl]-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one |
| Molecular Weight: | 403.91 |
| Molecular Formula: | C21 H25 N3 O3 |
| Salt: | HCl |
| Smiles: | CN1C(N(C)c2cc(COc3ccc(CNCC=C)cc3OC)ccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5313 |
| logD: | -0.4372 |
| logSw: | -2.9062 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.747 |
| InChI Key: | KZMYJKLOEWOPLB-UHFFFAOYSA-N |