10-[(3-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-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-[(furan-2-yl)methyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
10-[(3-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
Compound ID: | K788-8352 |
Compound Name: | 10-[(3-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide |
Molecular Weight: | 490.96 |
Molecular Formula: | C26 H19 Cl N2 O4 S |
Smiles: | C(c1ccco1)NC(c1ccc2c(c1)N(Cc1cccc(c1)[Cl])C(c1ccccc1S2=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.5112 |
logD: | 4.5112 |
logSw: | -4.6106 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.947 |
InChI Key: | ZPIMMQUCWQGPDS-UHFFFAOYSA-N |