(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)methyl N'-phenylcarbamimidothioate--hydrogen chloride (1/1)
Chemical Structure Depiction of
(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)methyl N'-phenylcarbamimidothioate--hydrogen chloride (1/1)
(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)methyl N'-phenylcarbamimidothioate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8006-7454 |
| Compound Name: | (2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)methyl N'-phenylcarbamimidothioate--hydrogen chloride (1/1) |
| Molecular Weight: | 351.87 |
| Molecular Formula: | C15 H13 N3 O S2 |
| Salt: | HCl |
| Smiles: | C(N1C(Oc2ccccc12)=S)SC(\N)=N/c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2832 |
| logD: | 3.2668 |
| logSw: | -3.7243 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 36.479 |
| InChI Key: | YZZUPLSWVGUKOX-UHFFFAOYSA-N |