2-[(1,3-benzothiazol-2-yl)amino]-2-oxoethyl N-benzoylmethioninate
Chemical Structure Depiction of
2-[(1,3-benzothiazol-2-yl)amino]-2-oxoethyl N-benzoylmethioninate
2-[(1,3-benzothiazol-2-yl)amino]-2-oxoethyl N-benzoylmethioninate
Compound characteristics
| Compound ID: | Y505-4381 |
| Compound Name: | 2-[(1,3-benzothiazol-2-yl)amino]-2-oxoethyl N-benzoylmethioninate |
| Molecular Weight: | 443.54 |
| Molecular Formula: | C21 H21 N3 O4 S2 |
| Smiles: | CSCCC(C(=O)OCC(Nc1nc2ccccc2s1)=O)NC(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4481 |
| logD: | 3.448 |
| logSw: | -3.778 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.322 |
| InChI Key: | GDEMURGCUKAEJN-INIZCTEOSA-N |