N-(2-aminoethyl)-N'-(2,3-dimethylphenyl)-N-(oxan-4-yl)urea--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-(2-aminoethyl)-N'-(2,3-dimethylphenyl)-N-(oxan-4-yl)urea--hydrogen chloride (1/1)
N-(2-aminoethyl)-N'-(2,3-dimethylphenyl)-N-(oxan-4-yl)urea--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | SA59-1301 |
| Compound Name: | N-(2-aminoethyl)-N'-(2,3-dimethylphenyl)-N-(oxan-4-yl)urea--hydrogen chloride (1/1) |
| Molecular Weight: | 327.85 |
| Molecular Formula: | C16 H25 N3 O2 |
| Salt: | HCl |
| Smiles: | Cc1cccc(c1C)NC(N(CCN)C1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0898 |
| logD: | -1.1214 |
| logSw: | -2.5488 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 52.86 |
| InChI Key: | USTNCKDQFPKRCR-UHFFFAOYSA-N |