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 |