N-[(3S,5S)-1-[3-(3-methoxyphenyl)propanoyl]-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
Chemical Structure Depiction of
N-[(3S,5S)-1-[3-(3-methoxyphenyl)propanoyl]-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
N-[(3S,5S)-1-[3-(3-methoxyphenyl)propanoyl]-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
Compound characteristics
| Compound ID: | SB18-1034 |
| Compound Name: | N-[(3S,5S)-1-[3-(3-methoxyphenyl)propanoyl]-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide |
| Molecular Weight: | 433.51 |
| Molecular Formula: | C24 H27 N5 O3 |
| Smiles: | Cc1nc([C@@H]2C[C@@H](CN2C(CCc2cccc(c2)OC)=O)NC(c2ccccc2)=O)[nH]n1 |
| Stereo: | ABSOLUTE |
| logP: | 2.6786 |
| logD: | 2.6779 |
| logSw: | -3.1353 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.241 |
| InChI Key: | ZIJHNBRCWPYHID-PZJWPPBQSA-N |