N-benzyl-1-(1-{[(4-methoxyphenyl)methyl]carbamoyl}azetidin-3-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-1-(1-{[(4-methoxyphenyl)methyl]carbamoyl}azetidin-3-yl)-1H-1,2,3-triazole-4-carboxamide
N-benzyl-1-(1-{[(4-methoxyphenyl)methyl]carbamoyl}azetidin-3-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | S724-1231 |
| Compound Name: | N-benzyl-1-(1-{[(4-methoxyphenyl)methyl]carbamoyl}azetidin-3-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 420.47 |
| Molecular Formula: | C22 H24 N6 O3 |
| Smiles: | COc1ccc(CNC(N2CC(C2)n2cc(C(NCc3ccccc3)=O)nn2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.5351 |
| logD: | 1.5351 |
| logSw: | -1.7131 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.191 |
| InChI Key: | AGLGPSBOCCTYCD-UHFFFAOYSA-N |