ethyl {4-[(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)carbamamido]phenyl}acetate
Chemical Structure Depiction of
ethyl {4-[(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)carbamamido]phenyl}acetate
ethyl {4-[(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)carbamamido]phenyl}acetate
Compound characteristics
| Compound ID: | G719-1217 |
| Compound Name: | ethyl {4-[(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)carbamamido]phenyl}acetate |
| Molecular Weight: | 421.5 |
| Molecular Formula: | C23 H27 N5 O3 |
| Smiles: | CCOC(Cc1ccc(cc1)NC(NCCc1nc(Cc2ccc(C)cc2)[nH]n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6298 |
| logD: | 3.6283 |
| logSw: | -3.6919 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.63 |
| InChI Key: | IEGNUNZMALRHMW-UHFFFAOYSA-N |