ethyl 2-{2-[2-(3-methoxyphenyl)-4-oxo-3,4-dihydro-5H-pyrido[2,3-b][1,4]diazepin-5-yl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 2-{2-[2-(3-methoxyphenyl)-4-oxo-3,4-dihydro-5H-pyrido[2,3-b][1,4]diazepin-5-yl]acetamido}benzoate
ethyl 2-{2-[2-(3-methoxyphenyl)-4-oxo-3,4-dihydro-5H-pyrido[2,3-b][1,4]diazepin-5-yl]acetamido}benzoate
Compound characteristics
Compound ID: | L385-0236 |
Compound Name: | ethyl 2-{2-[2-(3-methoxyphenyl)-4-oxo-3,4-dihydro-5H-pyrido[2,3-b][1,4]diazepin-5-yl]acetamido}benzoate |
Molecular Weight: | 472.5 |
Molecular Formula: | C26 H24 N4 O5 |
Smiles: | CCOC(c1ccccc1NC(CN1C(CC(c2cccc(c2)OC)=Nc2cccnc12)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.671 |
logD: | 3.649 |
logSw: | -3.9892 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 85.67 |
InChI Key: | XCKGWSSXUWJSAH-UHFFFAOYSA-N |