N-[(4-chlorophenyl)methyl]-N~2~-{cyclopentyl[(3,4,5-trimethoxyphenyl)methyl]carbamothioyl}glycinamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-N~2~-{cyclopentyl[(3,4,5-trimethoxyphenyl)methyl]carbamothioyl}glycinamide
N-[(4-chlorophenyl)methyl]-N~2~-{cyclopentyl[(3,4,5-trimethoxyphenyl)methyl]carbamothioyl}glycinamide
Compound characteristics
| Compound ID: | K784-5737 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-N~2~-{cyclopentyl[(3,4,5-trimethoxyphenyl)methyl]carbamothioyl}glycinamide |
| Molecular Weight: | 506.06 |
| Molecular Formula: | C25 H32 Cl N3 O4 S |
| Smiles: | COc1cc(CN(C2CCCC2)C(NCC(NCc2ccc(cc2)[Cl])=O)=S)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.5379 |
| logD: | 4.5379 |
| logSw: | -4.7231 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.81 |
| InChI Key: | RYGLNKXOJRHPBI-UHFFFAOYSA-N |