N-[2-(azepan-1-yl)ethyl]-N'-(4-phenoxyphenyl)-N-[(thiophen-2-yl)methyl]thiourea
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-N'-(4-phenoxyphenyl)-N-[(thiophen-2-yl)methyl]thiourea
N-[2-(azepan-1-yl)ethyl]-N'-(4-phenoxyphenyl)-N-[(thiophen-2-yl)methyl]thiourea
Compound characteristics
| Compound ID: | C087-0366 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-N'-(4-phenoxyphenyl)-N-[(thiophen-2-yl)methyl]thiourea |
| Molecular Weight: | 465.68 |
| Molecular Formula: | C26 H31 N3 O S2 |
| Smiles: | C1CCCN(CC1)CCN(Cc1cccs1)C(Nc1ccc(cc1)Oc1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 6.5751 |
| logD: | 3.7581 |
| logSw: | -6.026 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 22.486 |
| InChI Key: | ZBDCOUZFYFYWJR-UHFFFAOYSA-N |