ethyl 4-[2-(4-oxo-2-phenyl-3,4-dihydro-5H-pyrido[2,3-b][1,4]diazepin-5-yl)acetamido]benzoate
Chemical Structure Depiction of
ethyl 4-[2-(4-oxo-2-phenyl-3,4-dihydro-5H-pyrido[2,3-b][1,4]diazepin-5-yl)acetamido]benzoate
ethyl 4-[2-(4-oxo-2-phenyl-3,4-dihydro-5H-pyrido[2,3-b][1,4]diazepin-5-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | L385-0043 |
| Compound Name: | ethyl 4-[2-(4-oxo-2-phenyl-3,4-dihydro-5H-pyrido[2,3-b][1,4]diazepin-5-yl)acetamido]benzoate |
| Molecular Weight: | 442.47 |
| Molecular Formula: | C25 H22 N4 O4 |
| Smiles: | CCOC(c1ccc(cc1)NC(CN1C(CC(c2ccccc2)=Nc2cccnc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8628 |
| logD: | 3.8626 |
| logSw: | -3.9278 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.824 |
| InChI Key: | BPZKSQVRYUCYKX-UHFFFAOYSA-N |