ethyl 2-{[(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)methyl]amino}benzoate
Chemical Structure Depiction of
ethyl 2-{[(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)methyl]amino}benzoate
ethyl 2-{[(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)methyl]amino}benzoate
Compound characteristics
| Compound ID: | 8009-3431 |
| Compound Name: | ethyl 2-{[(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)methyl]amino}benzoate |
| Molecular Weight: | 328.39 |
| Molecular Formula: | C17 H16 N2 O3 S |
| Smiles: | CCOC(c1ccccc1NCN1C(Oc2ccccc12)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2844 |
| logD: | 4.2844 |
| logSw: | -4.3479 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.09 |
| InChI Key: | DDIDVKQDLRXGPN-UHFFFAOYSA-N |