ethyl 2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}benzoate
Chemical Structure Depiction of
ethyl 2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}benzoate
ethyl 2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}benzoate
Compound characteristics
| Compound ID: | 4401-0041 |
| Compound Name: | ethyl 2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}benzoate |
| Molecular Weight: | 315.37 |
| Molecular Formula: | C18 H21 N O4 |
| Smiles: | CCOC(c1ccccc1NC=C1C(CC(C)(C)CC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9589 |
| logD: | 0.6999 |
| logSw: | -3.3803 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.312 |
| InChI Key: | BQPQWYXDUBCKHD-UHFFFAOYSA-N |