N~2~-{cyclopentyl[(3,4,5-trimethoxyphenyl)methyl]carbamothioyl}-N-cyclopropylglycinamide
Chemical Structure Depiction of
N~2~-{cyclopentyl[(3,4,5-trimethoxyphenyl)methyl]carbamothioyl}-N-cyclopropylglycinamide
N~2~-{cyclopentyl[(3,4,5-trimethoxyphenyl)methyl]carbamothioyl}-N-cyclopropylglycinamide
Compound characteristics
| Compound ID: | K784-5738 |
| Compound Name: | N~2~-{cyclopentyl[(3,4,5-trimethoxyphenyl)methyl]carbamothioyl}-N-cyclopropylglycinamide |
| Molecular Weight: | 421.56 |
| Molecular Formula: | C21 H31 N3 O4 S |
| Smiles: | COc1cc(CN(C2CCCC2)C(NCC(NC2CC2)=O)=S)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.868 |
| logD: | 2.868 |
| logSw: | -3.2877 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.866 |
| InChI Key: | ZNJMKBIJENBETE-UHFFFAOYSA-N |