N-[rel-(3R,4S)-1-[3-(3-methoxyphenyl)propanoyl]-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-[3-(3-methoxyphenyl)propanoyl]-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
N-[rel-(3R,4S)-1-[3-(3-methoxyphenyl)propanoyl]-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
Compound characteristics
| Compound ID: | SB33-1246 |
| Compound Name: | N-[rel-(3R,4S)-1-[3-(3-methoxyphenyl)propanoyl]-4-(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]2CN(C[C@H]2NC(c2ccccc2)=O)C(CCc2cccc(c2)OC)=O)[nH]n1 |
| Stereo: | RELATIVE |
| logP: | 2.1539 |
| logD: | 2.1534 |
| logSw: | -2.9557 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.87 |
| InChI Key: | DJKGYNDCAODFOD-SFTDATJTSA-N |