10-[(3-chlorophenyl)methyl]-N-[2-(2-methylpiperidin-1-yl)ethyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-[(3-chlorophenyl)methyl]-N-[2-(2-methylpiperidin-1-yl)ethyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
10-[(3-chlorophenyl)methyl]-N-[2-(2-methylpiperidin-1-yl)ethyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
Compound ID: | K788-8383 |
Compound Name: | 10-[(3-chlorophenyl)methyl]-N-[2-(2-methylpiperidin-1-yl)ethyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide |
Molecular Weight: | 536.09 |
Molecular Formula: | C29 H30 Cl N3 O3 S |
Smiles: | CC1CCCCN1CCNC(c1ccc2c(c1)N(Cc1cccc(c1)[Cl])C(c1ccccc1S2=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.9975 |
logD: | 2.7648 |
logSw: | -4.3836 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.473 |
InChI Key: | TXVSMYBXHBVXJT-UHFFFAOYSA-N |