10-(4-ethylbenzene-1-sulfonyl)-11-(furan-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
10-(4-ethylbenzene-1-sulfonyl)-11-(furan-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
10-(4-ethylbenzene-1-sulfonyl)-11-(furan-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | J024-0741 |
| Compound Name: | 10-(4-ethylbenzene-1-sulfonyl)-11-(furan-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C25 H24 N2 O4 S |
| Smiles: | CCc1ccc(cc1)S(N1C(C2=C(CCCC2=O)Nc2ccccc12)c1ccco1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2626 |
| logD: | 5.2353 |
| logSw: | -5.0627 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.359 |
| InChI Key: | IAXIKTUSNGNIFA-VWLOTQADSA-N |