5,11-bis(4-methylbenzene-1-sulfonyl)dibenzo[b,f][1,5]diazocine-6,12(5H,11H)-dione
Chemical Structure Depiction of
5,11-bis(4-methylbenzene-1-sulfonyl)dibenzo[b,f][1,5]diazocine-6,12(5H,11H)-dione
5,11-bis(4-methylbenzene-1-sulfonyl)dibenzo[b,f][1,5]diazocine-6,12(5H,11H)-dione
Compound characteristics
| Compound ID: | 0590-0500 |
| Compound Name: | 5,11-bis(4-methylbenzene-1-sulfonyl)dibenzo[b,f][1,5]diazocine-6,12(5H,11H)-dione |
| Molecular Weight: | 546.62 |
| Molecular Formula: | C28 H22 N2 O6 S2 |
| Smiles: | Cc1ccc(cc1)S(N1C(c2ccccc2N(C(c2ccccc12)=O)S(c1ccc(C)cc1)(=O)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4251 |
| logD: | 4.4251 |
| logSw: | -4.5096 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 88.984 |
| InChI Key: | XQWRQKNERKKCCN-UHFFFAOYSA-N |