2-({6-[({4-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-3-nitrophenyl}methylidene)amino]-1,3-benzothiazol-2-yl}sulfanyl)-1-(morpholin-4-yl)ethan-1-one
Chemical Structure Depiction of
2-({6-[({4-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-3-nitrophenyl}methylidene)amino]-1,3-benzothiazol-2-yl}sulfanyl)-1-(morpholin-4-yl)ethan-1-one
2-({6-[({4-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-3-nitrophenyl}methylidene)amino]-1,3-benzothiazol-2-yl}sulfanyl)-1-(morpholin-4-yl)ethan-1-one
Compound characteristics
| Compound ID: | 8007-4348 |
| Compound Name: | 2-({6-[({4-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-3-nitrophenyl}methylidene)amino]-1,3-benzothiazol-2-yl}sulfanyl)-1-(morpholin-4-yl)ethan-1-one |
| Molecular Weight: | 554.67 |
| Molecular Formula: | C24 H22 N6 O4 S3 |
| Smiles: | Cn1ccnc1Sc1ccc(/C=N/c2ccc3c(c2)sc(n3)SCC(N2CCOCC2)=O)cc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0513 |
| logD: | 4.0481 |
| logSw: | -4.1826 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 87.205 |
| InChI Key: | PZFMTKCUAZDINW-UHFFFAOYSA-N |