N-{4-[3-(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)propanamido]benzene-1-sulfonyl}benzamide
Chemical Structure Depiction of
N-{4-[3-(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)propanamido]benzene-1-sulfonyl}benzamide
N-{4-[3-(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)propanamido]benzene-1-sulfonyl}benzamide
Compound characteristics
| Compound ID: | K869-0305 |
| Compound Name: | N-{4-[3-(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)propanamido]benzene-1-sulfonyl}benzamide |
| Molecular Weight: | 481.55 |
| Molecular Formula: | C23 H19 N3 O5 S2 |
| Smiles: | C(CN1C(Oc2ccccc12)=S)C(Nc1ccc(cc1)S(NC(c1ccccc1)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1954 |
| logD: | -0.8419 |
| logSw: | -3.8646 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.831 |
| InChI Key: | YKPUENIIFZABJD-UHFFFAOYSA-N |