methyl 3-{[(4-tert-butylbenzamido){[(pyridin-3-yl)methyl]amino}methylidene]amino}benzoate
Chemical Structure Depiction of
methyl 3-{[(4-tert-butylbenzamido){[(pyridin-3-yl)methyl]amino}methylidene]amino}benzoate
methyl 3-{[(4-tert-butylbenzamido){[(pyridin-3-yl)methyl]amino}methylidene]amino}benzoate
Compound characteristics
| Compound ID: | L087-0893 |
| Compound Name: | methyl 3-{[(4-tert-butylbenzamido){[(pyridin-3-yl)methyl]amino}methylidene]amino}benzoate |
| Molecular Weight: | 444.53 |
| Molecular Formula: | C26 H28 N4 O3 |
| Smiles: | CC(C)(C)c1ccc(cc1)C(NC(/NCc1cccnc1)=N/c1cccc(c1)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6734 |
| logD: | 4.6513 |
| logSw: | -4.1971 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.543 |
| InChI Key: | KKOIQTOMBMKGHY-UHFFFAOYSA-N |