ethyl N-{[3-(azepan-1-yl)propyl][(thiophen-2-yl)methyl]carbamothioyl}glycinate
Chemical Structure Depiction of
ethyl N-{[3-(azepan-1-yl)propyl][(thiophen-2-yl)methyl]carbamothioyl}glycinate
ethyl N-{[3-(azepan-1-yl)propyl][(thiophen-2-yl)methyl]carbamothioyl}glycinate
Compound characteristics
| Compound ID: | R152-1144 |
| Compound Name: | ethyl N-{[3-(azepan-1-yl)propyl][(thiophen-2-yl)methyl]carbamothioyl}glycinate |
| Molecular Weight: | 397.6 |
| Molecular Formula: | C19 H31 N3 O2 S2 |
| Smiles: | CCOC(CNC(N(CCCN1CCCCCC1)Cc1cccs1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5471 |
| logD: | 1.5103 |
| logSw: | -3.5462 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.491 |
| InChI Key: | NQVNVGCIEADNHG-UHFFFAOYSA-N |