N-(3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(3-chlorophenyl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-(3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(3-chlorophenyl)-1,2-oxazole-3-carboxamide
N-(3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(3-chlorophenyl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-1480 |
| Compound Name: | N-(3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(3-chlorophenyl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 415.9 |
| Molecular Formula: | C20 H18 Cl N3 O3 S |
| Smiles: | CC1CCc2c(C(N)=O)c(NC(c3cc(c4cccc(c4)[Cl])on3)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8068 |
| logD: | 3.3773 |
| logSw: | -4.6936 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.639 |
| InChI Key: | MRALUQRUTCMZAU-SNVBAGLBSA-N |