2-(4-fluorophenoxy)-N-[3-(methoxymethyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl]acetamide
Chemical Structure Depiction of
2-(4-fluorophenoxy)-N-[3-(methoxymethyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl]acetamide
2-(4-fluorophenoxy)-N-[3-(methoxymethyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl]acetamide
Compound characteristics
| Compound ID: | S637-0624 |
| Compound Name: | 2-(4-fluorophenoxy)-N-[3-(methoxymethyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl]acetamide |
| Molecular Weight: | 348.38 |
| Molecular Formula: | C17 H21 F N4 O3 |
| Smiles: | COCc1nnc2CCC(CCn12)NC(COc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.695 |
| logD: | 0.6941 |
| logSw: | -1.7887 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.166 |
| InChI Key: | KXDNPSSFUBBOPF-ZDUSSCGKSA-N |