N-(3-methylbutyl)-1-[(propan-2-yl)carbamothioyl]-4-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide
Chemical Structure Depiction of
N-(3-methylbutyl)-1-[(propan-2-yl)carbamothioyl]-4-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide
N-(3-methylbutyl)-1-[(propan-2-yl)carbamothioyl]-4-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | V028-2514 |
| Compound Name: | N-(3-methylbutyl)-1-[(propan-2-yl)carbamothioyl]-4-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide |
| Molecular Weight: | 451.63 |
| Molecular Formula: | C23 H37 N3 O4 S |
| Salt: | not_available |
| Smiles: | CC(C)CCNC(C1CN(CC1c1cc(c(c(c1)OC)OC)OC)C(NC(C)C)=S)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4988 |
| logD: | 3.4988 |
| logSw: | -3.9047 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.17 |
| InChI Key: | PEVOLRZELWFDJN-UHFFFAOYSA-N |