N-[(3S,5S)-5-(3-methyl-1H-1,2,4-triazol-5-yl)-1-(pyrimidine-4-carbonyl)pyrrolidin-3-yl]benzamide
Chemical Structure Depiction of
N-[(3S,5S)-5-(3-methyl-1H-1,2,4-triazol-5-yl)-1-(pyrimidine-4-carbonyl)pyrrolidin-3-yl]benzamide
N-[(3S,5S)-5-(3-methyl-1H-1,2,4-triazol-5-yl)-1-(pyrimidine-4-carbonyl)pyrrolidin-3-yl]benzamide
Compound characteristics
| Compound ID: | SB18-0304 |
| Compound Name: | N-[(3S,5S)-5-(3-methyl-1H-1,2,4-triazol-5-yl)-1-(pyrimidine-4-carbonyl)pyrrolidin-3-yl]benzamide |
| Molecular Weight: | 377.4 |
| Molecular Formula: | C19 H19 N7 O2 |
| Smiles: | Cc1nc([C@@H]2C[C@@H](CN2C(c2ccncn2)=O)NC(c2ccccc2)=O)[nH]n1 |
| Stereo: | ABSOLUTE |
| logP: | 0.3617 |
| logD: | 0.361 |
| logSw: | -1.3028 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.415 |
| InChI Key: | OVIFFKGVISVWMS-ZBFHGGJFSA-N |