4-chloro-N-{[4-(4-methoxyphenyl)oxan-4-yl]methyl}-2-(1H-tetrazol-1-yl)benzamide
Chemical Structure Depiction of
4-chloro-N-{[4-(4-methoxyphenyl)oxan-4-yl]methyl}-2-(1H-tetrazol-1-yl)benzamide
4-chloro-N-{[4-(4-methoxyphenyl)oxan-4-yl]methyl}-2-(1H-tetrazol-1-yl)benzamide
Compound characteristics
| Compound ID: | Y041-5596 |
| Compound Name: | 4-chloro-N-{[4-(4-methoxyphenyl)oxan-4-yl]methyl}-2-(1H-tetrazol-1-yl)benzamide |
| Molecular Weight: | 427.89 |
| Molecular Formula: | C21 H22 Cl N5 O3 |
| Smiles: | COc1ccc(cc1)C1(CCOCC1)CNC(c1ccc(cc1n1cnnn1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8818 |
| logD: | 3.8818 |
| logSw: | -4.4172 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.489 |
| InChI Key: | JUQGVNSDCIXSOV-UHFFFAOYSA-N |