methyl 4-[2-(6,7-dimethyl-10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamido]benzoate
Chemical Structure Depiction of
methyl 4-[2-(6,7-dimethyl-10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamido]benzoate
methyl 4-[2-(6,7-dimethyl-10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | F403-0180 |
| Compound Name: | methyl 4-[2-(6,7-dimethyl-10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamido]benzoate |
| Molecular Weight: | 419.48 |
| Molecular Formula: | C24 H25 N3 O4 |
| Smiles: | Cc1cc2c(cc1C)N(CC(Nc1ccc(cc1)C(=O)OC)=O)C(C1CCCC1=N2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8677 |
| logD: | 3.8675 |
| logSw: | -4.1495 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.687 |
| InChI Key: | LJNPWKQMVIRWOJ-SFHVURJKSA-N |