N-[(3-chlorophenyl)methyl]-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
Chemical Structure Depiction of
N-[(3-chlorophenyl)methyl]-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
N-[(3-chlorophenyl)methyl]-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
Compound characteristics
| Compound ID: | Y040-9150 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide |
| Molecular Weight: | 304.77 |
| Molecular Formula: | C16 H17 Cl N2 O2 |
| Smiles: | C1CCc2c(C(NCc3cccc(c3)[Cl])=O)noc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.6205 |
| logD: | 3.6205 |
| logSw: | -3.887 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.383 |
| InChI Key: | VVRYPPAIBJCTNE-UHFFFAOYSA-N |