6-methyl-1,1-dioxo-4-[3-(trifluoromethyl)phenyl]-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Chemical Structure Depiction of
6-methyl-1,1-dioxo-4-[3-(trifluoromethyl)phenyl]-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
6-methyl-1,1-dioxo-4-[3-(trifluoromethyl)phenyl]-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Compound characteristics
Compound ID: | L807-0562 |
Compound Name: | 6-methyl-1,1-dioxo-4-[3-(trifluoromethyl)phenyl]-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile |
Molecular Weight: | 364.34 |
Molecular Formula: | C17 H11 F3 N2 O2 S |
Smiles: | Cc1ccc2c(c1)N(C=C(C#N)S2(=O)=O)c1cccc(c1)C(F)(F)F |
Stereo: | ACHIRAL |
logP: | 3.3613 |
logD: | 3.3613 |
logSw: | -3.8303 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 48.007 |
InChI Key: | LRBUFXVWVCRYTF-UHFFFAOYSA-N |