N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-(4-phenoxyphenyl)-N-[(pyridin-3-yl)methyl]thiourea
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-(4-phenoxyphenyl)-N-[(pyridin-3-yl)methyl]thiourea
N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-(4-phenoxyphenyl)-N-[(pyridin-3-yl)methyl]thiourea
Compound characteristics
| Compound ID: | C087-0401 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-(4-phenoxyphenyl)-N-[(pyridin-3-yl)methyl]thiourea |
| Molecular Weight: | 499.63 |
| Molecular Formula: | C29 H29 N3 O3 S |
| Smiles: | COc1ccc(CCN(Cc2cccnc2)C(Nc2ccc(cc2)Oc2ccccc2)=S)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.2789 |
| logD: | 5.2783 |
| logSw: | -5.1274 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.933 |
| InChI Key: | AWGFELHBZIFBKV-UHFFFAOYSA-N |