N-[(3S,5S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
Chemical Structure Depiction of
N-[(3S,5S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
N-[(3S,5S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
Compound characteristics
| Compound ID: | SB18-0393 |
| Compound Name: | N-[(3S,5S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide |
| Molecular Weight: | 382.49 |
| Molecular Formula: | C19 H22 N6 O S |
| Smiles: | Cc1c(CN2C[C@H](C[C@H]2c2nc(C)n[nH]2)NC(c2ccccc2)=O)scn1 |
| Stereo: | ABSOLUTE |
| logP: | 1.686 |
| logD: | 1.6814 |
| logSw: | -2.4611 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.679 |
| InChI Key: | UWKYLWQHZLTCIL-CVEARBPZSA-N |