2-({[4-benzyl-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[(pyridin-4-yl)methyl]benzamide
Chemical Structure Depiction of
2-({[4-benzyl-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[(pyridin-4-yl)methyl]benzamide
2-({[4-benzyl-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[(pyridin-4-yl)methyl]benzamide
Compound characteristics
| Compound ID: | V015-4797 |
| Compound Name: | 2-({[4-benzyl-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[(pyridin-4-yl)methyl]benzamide |
| Molecular Weight: | 459.57 |
| Molecular Formula: | C25 H25 N5 O2 S |
| Salt: | not_available |
| Smiles: | COCc1nnc(n1Cc1ccccc1)SCc1ccccc1C(NCc1ccncc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0366 |
| logD: | 3.0332 |
| logSw: | -3.4002 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.482 |
| InChI Key: | MGGHLCKQKBMHOC-UHFFFAOYSA-N |