4-(2-ethoxynaphthalene-1-carbonyl)-5-(4-fluorophenyl)-7-methyl-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Chemical Structure Depiction of
4-(2-ethoxynaphthalene-1-carbonyl)-5-(4-fluorophenyl)-7-methyl-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
4-(2-ethoxynaphthalene-1-carbonyl)-5-(4-fluorophenyl)-7-methyl-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Compound characteristics
| Compound ID: | C076-0023 |
| Compound Name: | 4-(2-ethoxynaphthalene-1-carbonyl)-5-(4-fluorophenyl)-7-methyl-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one |
| Molecular Weight: | 468.53 |
| Molecular Formula: | C29 H25 F N2 O3 |
| Smiles: | CCOc1ccc2ccccc2c1C(N1CC(Nc2ccc(C)cc2C1c1ccc(cc1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6848 |
| logD: | 5.6848 |
| logSw: | -6.6516 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.965 |
| InChI Key: | KMBNGXKQHTWWJC-NDEPHWFRSA-N |