N-[3-(azepan-1-yl)propyl]-N-[(furan-2-yl)methyl]-N'-(4-phenoxyphenyl)thiourea
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-N-[(furan-2-yl)methyl]-N'-(4-phenoxyphenyl)thiourea
N-[3-(azepan-1-yl)propyl]-N-[(furan-2-yl)methyl]-N'-(4-phenoxyphenyl)thiourea
Compound characteristics
| Compound ID: | C087-0382 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-N-[(furan-2-yl)methyl]-N'-(4-phenoxyphenyl)thiourea |
| Molecular Weight: | 463.64 |
| Molecular Formula: | C27 H33 N3 O2 S |
| Smiles: | C1CCCN(CC1)CCCN(Cc1ccco1)C(Nc1ccc(cc1)Oc1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 6.4245 |
| logD: | 4.3878 |
| logSw: | -6.0057 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.2164 |
| InChI Key: | HHXMPMJOTBCGAO-UHFFFAOYSA-N |