11-(furan-2-yl)-3,3-dimethyl-10-(4-methylbenzene-1-sulfonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
11-(furan-2-yl)-3,3-dimethyl-10-(4-methylbenzene-1-sulfonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
11-(furan-2-yl)-3,3-dimethyl-10-(4-methylbenzene-1-sulfonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 8018-9098 |
| Compound Name: | 11-(furan-2-yl)-3,3-dimethyl-10-(4-methylbenzene-1-sulfonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 462.57 |
| Molecular Formula: | C26 H26 N2 O4 S |
| Smiles: | Cc1ccc(cc1)S(N1C(C2=C(CC(C)(C)CC2=O)Nc2ccccc12)c1ccco1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3609 |
| logD: | 5.2963 |
| logSw: | -5.3505 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.359 |
| InChI Key: | JKNDWBPGWNIOEI-VWLOTQADSA-N |