5-(2-chlorobenzoyl)-3-(3-ethylphenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Chemical Structure Depiction of
5-(2-chlorobenzoyl)-3-(3-ethylphenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
5-(2-chlorobenzoyl)-3-(3-ethylphenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Compound characteristics
| Compound ID: | C200-1218 |
| Compound Name: | 5-(2-chlorobenzoyl)-3-(3-ethylphenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one |
| Molecular Weight: | 446.93 |
| Molecular Formula: | C26 H23 Cl N2 O3 |
| Smiles: | CCc1cccc(c1)N1C(N(C2CC1(C)Oc1ccccc12)C(c1ccccc1[Cl])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.698 |
| logD: | 5.698 |
| logSw: | -5.8533 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.191 |
| InChI Key: | JVOAMQRCQIOTBO-UHFFFAOYSA-N |