N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-chlorobenzoyl)-4-(3-methoxyphenyl)pyrrolidine-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-chlorobenzoyl)-4-(3-methoxyphenyl)pyrrolidine-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-chlorobenzoyl)-4-(3-methoxyphenyl)pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | V003-7696 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-chlorobenzoyl)-4-(3-methoxyphenyl)pyrrolidine-3-carboxamide |
| Molecular Weight: | 492.96 |
| Molecular Formula: | C27 H25 Cl N2 O5 |
| Smiles: | COc1cccc(c1)C1CN(CC1C(NCc1ccc2c(c1)OCO2)=O)C(c1ccc(cc1)[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.967 |
| logD: | 3.967 |
| logSw: | -4.5936 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.921 |
| InChI Key: | GZXAWWCVYKZALO-UHFFFAOYSA-N |