(1-{[(2S)-1-(3-methylbenzoyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(piperidin-1-yl)methanone
Chemical Structure Depiction of
(1-{[(2S)-1-(3-methylbenzoyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(piperidin-1-yl)methanone
(1-{[(2S)-1-(3-methylbenzoyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(piperidin-1-yl)methanone
Compound characteristics
| Compound ID: | SB20-1142 |
| Compound Name: | (1-{[(2S)-1-(3-methylbenzoyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(piperidin-1-yl)methanone |
| Molecular Weight: | 381.48 |
| Molecular Formula: | C21 H27 N5 O2 |
| Smiles: | Cc1cccc(c1)C(N1CCC[C@H]1Cn1cc(C(N2CCCCC2)=O)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.11 |
| logD: | 2.11 |
| logSw: | -2.3498 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.061 |
| InChI Key: | ITYHEEURPPORJN-SFHVURJKSA-N |