13-ethyl-5,11-bis(4-methylbenzene-1-sulfonyl)-5,6,11,12-tetrahydro-6,12-epiminodibenzo[b,f][1,5]diazocine
Chemical Structure Depiction of
13-ethyl-5,11-bis(4-methylbenzene-1-sulfonyl)-5,6,11,12-tetrahydro-6,12-epiminodibenzo[b,f][1,5]diazocine
13-ethyl-5,11-bis(4-methylbenzene-1-sulfonyl)-5,6,11,12-tetrahydro-6,12-epiminodibenzo[b,f][1,5]diazocine
Compound characteristics
| Compound ID: | 3824-0076 |
| Compound Name: | 13-ethyl-5,11-bis(4-methylbenzene-1-sulfonyl)-5,6,11,12-tetrahydro-6,12-epiminodibenzo[b,f][1,5]diazocine |
| Molecular Weight: | 559.71 |
| Molecular Formula: | C30 H29 N3 O4 S2 |
| Smiles: | CCN1C2c3ccccc3N(C1c1ccccc1N2S(c1ccc(C)cc1)(=O)=O)S(c1ccc(C)cc1)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.8025 |
| logD: | 6.8025 |
| logSw: | -5.9359 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.32 |
| InChI Key: | OIASVRNJBKVRNZ-UHFFFAOYSA-N |