N-[(4-chlorophenyl)methyl]-5-methyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-5-methyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
N-[(4-chlorophenyl)methyl]-5-methyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Compound characteristics
| Compound ID: | E920-0550 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-5-methyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide |
| Molecular Weight: | 304.77 |
| Molecular Formula: | C16 H17 Cl N2 O2 |
| Smiles: | CC1CCc2c(C1)c(C(NCc1ccc(cc1)[Cl])=O)no2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5628 |
| logD: | 3.5627 |
| logSw: | -3.9928 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.052 |
| InChI Key: | WTFSVBXXTKMDEX-SNVBAGLBSA-N |