methyl 5-ethyl-2-[2-(3-oxo-1,2,3,4-tetrahydronaphtho[1,8-ef][1,4]diazepin-2-yl)acetamido]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 5-ethyl-2-[2-(3-oxo-1,2,3,4-tetrahydronaphtho[1,8-ef][1,4]diazepin-2-yl)acetamido]thiophene-3-carboxylate
methyl 5-ethyl-2-[2-(3-oxo-1,2,3,4-tetrahydronaphtho[1,8-ef][1,4]diazepin-2-yl)acetamido]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 7388-0026 |
| Compound Name: | methyl 5-ethyl-2-[2-(3-oxo-1,2,3,4-tetrahydronaphtho[1,8-ef][1,4]diazepin-2-yl)acetamido]thiophene-3-carboxylate |
| Molecular Weight: | 423.49 |
| Molecular Formula: | C22 H21 N3 O4 S |
| Smiles: | CCc1cc(C(=O)OC)c(NC(CC2C(Nc3cccc4cccc(c34)N2)=O)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0123 |
| logD: | 2.1311 |
| logSw: | -4.5479 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.275 |
| InChI Key: | BYNBOLOESOPZAX-KRWDZBQOSA-N |