1-(morpholin-4-yl)-2-[(6-{[(4-nitrophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(morpholin-4-yl)-2-[(6-{[(4-nitrophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one
1-(morpholin-4-yl)-2-[(6-{[(4-nitrophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | 8006-7979 |
| Compound Name: | 1-(morpholin-4-yl)-2-[(6-{[(4-nitrophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 442.51 |
| Molecular Formula: | C20 H18 N4 O4 S2 |
| Smiles: | C1COCCN1C(CSc1nc2ccc(cc2s1)/N=C/c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2857 |
| logD: | 3.2852 |
| logSw: | -3.5237 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.858 |
| InChI Key: | DIUHEXJZGAWTBO-UHFFFAOYSA-N |