ethyl 4-(2-{[(2,4-dimethyl-3H-1,5-benzodiazepin-3-ylidene)amino]oxy}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{[(2,4-dimethyl-3H-1,5-benzodiazepin-3-ylidene)amino]oxy}acetamido)benzoate
ethyl 4-(2-{[(2,4-dimethyl-3H-1,5-benzodiazepin-3-ylidene)amino]oxy}acetamido)benzoate
Compound characteristics
| Compound ID: | 8013-2189 |
| Compound Name: | ethyl 4-(2-{[(2,4-dimethyl-3H-1,5-benzodiazepin-3-ylidene)amino]oxy}acetamido)benzoate |
| Molecular Weight: | 406.44 |
| Molecular Formula: | C22 H22 N4 O4 |
| Smiles: | CCOC(c1ccc(cc1)NC(CON=C1C(C)=Nc2ccccc2N=C1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8784 |
| logD: | 3.8784 |
| logSw: | -4.0136 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.163 |
| InChI Key: | KOONFYSSBVIUBE-UHFFFAOYSA-N |