(3-{[(2-fluorophenyl)methyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indol-5-yl)acetic acid
Chemical Structure Depiction of
(3-{[(2-fluorophenyl)methyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indol-5-yl)acetic acid
(3-{[(2-fluorophenyl)methyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indol-5-yl)acetic acid
Compound characteristics
| Compound ID: | 8012-5296 |
| Compound Name: | (3-{[(2-fluorophenyl)methyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indol-5-yl)acetic acid |
| Molecular Weight: | 368.39 |
| Molecular Formula: | C18 H13 F N4 O2 S |
| Smiles: | C(C(O)=O)n1c2ccccc2c2c1nc(nn2)SCc1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 2.6559 |
| logD: | -1.4772 |
| logSw: | -2.7724 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.362 |
| InChI Key: | GHEWKRUZAFYTPN-UHFFFAOYSA-N |