5-{[1-(1,3-benzoxazol-2-yl)-3,5-dimethyl-1H-pyrazol-4-yl]sulfanyl}-1,3,4-thiadiazol-2-amine
Chemical Structure Depiction of
5-{[1-(1,3-benzoxazol-2-yl)-3,5-dimethyl-1H-pyrazol-4-yl]sulfanyl}-1,3,4-thiadiazol-2-amine
5-{[1-(1,3-benzoxazol-2-yl)-3,5-dimethyl-1H-pyrazol-4-yl]sulfanyl}-1,3,4-thiadiazol-2-amine
Compound characteristics
| Compound ID: | L150-0136 |
| Compound Name: | 5-{[1-(1,3-benzoxazol-2-yl)-3,5-dimethyl-1H-pyrazol-4-yl]sulfanyl}-1,3,4-thiadiazol-2-amine |
| Molecular Weight: | 344.41 |
| Molecular Formula: | C14 H12 N6 O S2 |
| Smiles: | Cc1c(c(C)n(c2nc3ccccc3o2)n1)Sc1nnc(N)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.576 |
| logD: | 2.576 |
| logSw: | -2.7435 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.201 |
| InChI Key: | APCXFVSNVOYJGZ-UHFFFAOYSA-N |