4-(3-bromophenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Chemical Structure Depiction of
4-(3-bromophenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
4-(3-bromophenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Compound characteristics
| Compound ID: | L807-0061 |
| Compound Name: | 4-(3-bromophenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile |
| Molecular Weight: | 361.21 |
| Molecular Formula: | C15 H9 Br N2 O2 S |
| Smiles: | C1=C(C#N)S(c2ccccc2N1c1cccc(c1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6813 |
| logD: | 2.6813 |
| logSw: | -3.1569 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.007 |
| InChI Key: | NKJWBIBLLDCXSH-UHFFFAOYSA-N |