N-(3-chloro-4-methoxyphenyl)-3-(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)propanamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-3-(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)propanamide
N-(3-chloro-4-methoxyphenyl)-3-(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)propanamide
Compound characteristics
| Compound ID: | K953-0391 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-3-(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)propanamide |
| Molecular Weight: | 362.83 |
| Molecular Formula: | C17 H15 Cl N2 O3 S |
| Smiles: | COc1ccc(cc1[Cl])NC(CCN1C(Oc2ccccc12)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8122 |
| logD: | 3.8101 |
| logSw: | -4.3412 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.633 |
| InChI Key: | QYIHVZOFSJGCJL-UHFFFAOYSA-N |