N-(3-chloro-2-methylphenyl)-5-methyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-5-methyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
N-(3-chloro-2-methylphenyl)-5-methyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Compound characteristics
| Compound ID: | E920-0588 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-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(Nc1cccc(c1C)[Cl])=O)no2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3823 |
| logD: | 4.3791 |
| logSw: | -4.3589 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.032 |
| InChI Key: | YGKKBWGFEGPDRI-SECBINFHSA-N |