N-[3-(azepan-1-yl)propyl]-N'-(3-chloro-4-methylphenyl)-N-[(thiophen-2-yl)methyl]thiourea
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-N'-(3-chloro-4-methylphenyl)-N-[(thiophen-2-yl)methyl]thiourea
N-[3-(azepan-1-yl)propyl]-N'-(3-chloro-4-methylphenyl)-N-[(thiophen-2-yl)methyl]thiourea
Compound characteristics
| Compound ID: | C087-0211 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-N'-(3-chloro-4-methylphenyl)-N-[(thiophen-2-yl)methyl]thiourea |
| Molecular Weight: | 436.08 |
| Molecular Formula: | C22 H30 Cl N3 S2 |
| Smiles: | Cc1ccc(cc1[Cl])NC(N(CCCN1CCCCCC1)Cc1cccs1)=S |
| Stereo: | ACHIRAL |
| logP: | 6.5493 |
| logD: | 4.5125 |
| logSw: | -6.4066 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 15.7382 |
| InChI Key: | OIWAJHBGWLCZQV-UHFFFAOYSA-N |