(4-{[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]methyl}phenoxy)acetic acid
Chemical Structure Depiction of
(4-{[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]methyl}phenoxy)acetic acid
(4-{[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]methyl}phenoxy)acetic acid
Compound characteristics
| Compound ID: | 8007-7577 |
| Compound Name: | (4-{[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]methyl}phenoxy)acetic acid |
| Molecular Weight: | 340.4 |
| Molecular Formula: | C18 H16 N2 O3 S |
| Smiles: | C1CCc2c(C1)c(C#N)c(/N=C/c1ccc(cc1)OCC(O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.3857 |
| logD: | -0.8512 |
| logSw: | -3.7701 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.02 |
| InChI Key: | OJCDIRUBWPUNJA-UHFFFAOYSA-N |