10-acetyl-11-(3-butoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
10-acetyl-11-(3-butoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
10-acetyl-11-(3-butoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 3046-8821 |
| Compound Name: | 10-acetyl-11-(3-butoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 432.56 |
| Molecular Formula: | C27 H32 N2 O3 |
| Smiles: | CCCCOc1cccc(c1)C1C2=C(CC(C)(C)CC2=O)Nc2ccccc2N1C(C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.491 |
| logD: | 5.2612 |
| logSw: | -5.3192 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.322 |
| InChI Key: | ZQSRUMGIKOTNIK-SANMLTNESA-N |