10-[(4-fluorophenyl)methyl]-8-[4-(2-fluorophenyl)piperazine-1-carbonyl]-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-5,5,11(10H)-trione
Chemical Structure Depiction of
10-[(4-fluorophenyl)methyl]-8-[4-(2-fluorophenyl)piperazine-1-carbonyl]-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-5,5,11(10H)-trione
10-[(4-fluorophenyl)methyl]-8-[4-(2-fluorophenyl)piperazine-1-carbonyl]-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-5,5,11(10H)-trione
Compound characteristics
Compound ID: | C530-1225 |
Compound Name: | 10-[(4-fluorophenyl)methyl]-8-[4-(2-fluorophenyl)piperazine-1-carbonyl]-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-5,5,11(10H)-trione |
Molecular Weight: | 573.62 |
Molecular Formula: | C31 H25 F2 N3 O4 S |
Smiles: | C1CN(CCN1C(c1ccc2c(c1)N(Cc1ccc(cc1)F)C(c1ccccc1S2(=O)=O)=O)=O)c1ccccc1F |
Stereo: | ACHIRAL |
logP: | 4.4087 |
logD: | 4.4087 |
logSw: | -4.367 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 63.989 |
InChI Key: | ALGPEBPSOAIOPS-UHFFFAOYSA-N |