N-(5-chloro-2,4-dimethoxyphenyl)-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide
N-(5-chloro-2,4-dimethoxyphenyl)-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide
Compound characteristics
| Compound ID: | F403-0053 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide |
| Molecular Weight: | 427.89 |
| Molecular Formula: | C22 H22 Cl N3 O4 |
| Smiles: | COc1cc(c(cc1NC(CN1C(C2CCCC2=Nc2ccccc12)=O)=O)[Cl])OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1383 |
| logD: | 3.1236 |
| logSw: | -3.4388 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.076 |
| InChI Key: | HGEFGQGOWNLTID-ZDUSSCGKSA-N |