10-benzyl-8-(4-benzylpiperazine-1-carbonyl)-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-5,11(10H)-dione
Chemical Structure Depiction of
10-benzyl-8-(4-benzylpiperazine-1-carbonyl)-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-5,11(10H)-dione
10-benzyl-8-(4-benzylpiperazine-1-carbonyl)-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-5,11(10H)-dione
Compound characteristics
Compound ID: | C529-1477 |
Compound Name: | 10-benzyl-8-(4-benzylpiperazine-1-carbonyl)-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-5,11(10H)-dione |
Molecular Weight: | 535.67 |
Molecular Formula: | C32 H29 N3 O3 S |
Smiles: | C1CN(CCN1Cc1ccccc1)C(c1ccc2c(c1)N(Cc1ccccc1)C(c1ccccc1S2=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7525 |
logD: | 3.7371 |
logSw: | -4.1075 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 50.973 |
InChI Key: | HOYPUTMYYNDIFW-UHFFFAOYSA-N |