3-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}benzoic acid
Chemical Structure Depiction of
3-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}benzoic acid
3-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}benzoic acid
Compound characteristics
| Compound ID: | 6646-0068 |
| Compound Name: | 3-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}benzoic acid |
| Molecular Weight: | 279.27 |
| Molecular Formula: | C10 H9 N5 O3 S |
| Smiles: | C(C(N)=O)Sc1nnnn1c1cccc(c1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6664 |
| logD: | -3.4515 |
| logSw: | -1.7552 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.956 |
| InChI Key: | WUJHBPKAHRXETD-UHFFFAOYSA-N |