(5-{[2-(3-nitroanilino)-2-oxoethyl]sulfanyl}-1H-tetrazol-1-yl)acetic acid
Chemical Structure Depiction of
(5-{[2-(3-nitroanilino)-2-oxoethyl]sulfanyl}-1H-tetrazol-1-yl)acetic acid
(5-{[2-(3-nitroanilino)-2-oxoethyl]sulfanyl}-1H-tetrazol-1-yl)acetic acid
Compound characteristics
| Compound ID: | 8012-8675 |
| Compound Name: | (5-{[2-(3-nitroanilino)-2-oxoethyl]sulfanyl}-1H-tetrazol-1-yl)acetic acid |
| Molecular Weight: | 338.3 |
| Molecular Formula: | C11 H10 N6 O5 S |
| Smiles: | C(C(O)=O)n1c(nnn1)SCC(Nc1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.46 |
| logD: | -3.8409 |
| logSw: | -2.32 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 124.939 |
| InChI Key: | MSAOEBBRWVUSTE-UHFFFAOYSA-N |