methyl 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
methyl 2-{2-[2-(3-methoxyphenyl)-4-oxo-3,4-dihydro-5H-pyrido[2,3-b][1,4]diazepin-5-yl]acetamido}benzoate
methyl 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: | L385-0269 |
| Compound Name: | methyl 2-{2-[2-(3-methoxyphenyl)-4-oxo-3,4-dihydro-5H-pyrido[2,3-b][1,4]diazepin-5-yl]acetamido}benzoate |
| Molecular Weight: | 458.47 |
| Molecular Formula: | C25 H22 N4 O5 |
| Smiles: | COC(c1ccccc1NC(CN1C(CC(c2cccc(c2)OC)=Nc2cccnc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1274 |
| logD: | 3.1053 |
| logSw: | -3.4345 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.09 |
| InChI Key: | FCAVYHAWDMQXSU-UHFFFAOYSA-N |