N-[2-(azepan-1-yl)ethyl]-N-[(furan-2-yl)methyl]-N'-(2-methoxyphenyl)thiourea
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-N-[(furan-2-yl)methyl]-N'-(2-methoxyphenyl)thiourea
N-[2-(azepan-1-yl)ethyl]-N-[(furan-2-yl)methyl]-N'-(2-methoxyphenyl)thiourea
Compound characteristics
| Compound ID: | C087-0843 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-N-[(furan-2-yl)methyl]-N'-(2-methoxyphenyl)thiourea |
| Molecular Weight: | 387.54 |
| Molecular Formula: | C21 H29 N3 O2 S |
| Smiles: | COc1ccccc1NC(N(CCN1CCCCCC1)Cc1ccco1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.5571 |
| logD: | 1.732 |
| logSw: | -4.1817 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.4012 |
| InChI Key: | OTELCJHKYAVPFU-UHFFFAOYSA-N |