N-[3-(azepan-1-yl)propyl]-N'-(4-chloro-2-methoxy-5-methylphenyl)-N-[(furan-2-yl)methyl]thiourea
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-N'-(4-chloro-2-methoxy-5-methylphenyl)-N-[(furan-2-yl)methyl]thiourea
N-[3-(azepan-1-yl)propyl]-N'-(4-chloro-2-methoxy-5-methylphenyl)-N-[(furan-2-yl)methyl]thiourea
Compound characteristics
| Compound ID: | C087-1249 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-N'-(4-chloro-2-methoxy-5-methylphenyl)-N-[(furan-2-yl)methyl]thiourea |
| Molecular Weight: | 450.04 |
| Molecular Formula: | C23 H32 Cl N3 O2 S |
| Smiles: | Cc1cc(c(cc1[Cl])OC)NC(N(CCCN1CCCCCC1)Cc1ccco1)=S |
| Stereo: | ACHIRAL |
| logP: | 6.029 |
| logD: | 3.9923 |
| logSw: | -6.1428 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.4012 |
| InChI Key: | WPKNGVKUBJMGBR-UHFFFAOYSA-N |