10-[(3-methylphenyl)methyl]-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
10-[(3-methylphenyl)methyl]-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
10-[(3-methylphenyl)methyl]-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | J024-0544 |
| Compound Name: | 10-[(3-methylphenyl)methyl]-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 400.54 |
| Molecular Formula: | C25 H24 N2 O S |
| Smiles: | Cc1cccc(CN2C(C3=C(CCCC3=O)Nc3ccccc23)c2cccs2)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7335 |
| logD: | 5.7237 |
| logSw: | -5.3379 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.5986 |
| InChI Key: | ULYXVPJNUHSZQJ-VWLOTQADSA-N |