N-[2-(butylcarbamoyl)phenyl]-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carboxamide
Chemical Structure Depiction of
N-[2-(butylcarbamoyl)phenyl]-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carboxamide
N-[2-(butylcarbamoyl)phenyl]-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carboxamide
Compound characteristics
Compound ID: | J097-0170 |
Compound Name: | N-[2-(butylcarbamoyl)phenyl]-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carboxamide |
Molecular Weight: | 463.55 |
Molecular Formula: | C25 H25 N3 O4 S |
Smiles: | CCCCNC(c1ccccc1NC(c1ccc2c(c1)c1ccccc1S(N2C)(=O)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.5593 |
logD: | 4.5513 |
logSw: | -4.2652 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 78.959 |
InChI Key: | CTVKTBWCAYVOCI-UHFFFAOYSA-N |