2-({4-methyl-5-[(naphthalen-1-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide
Chemical Structure Depiction of
2-({4-methyl-5-[(naphthalen-1-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide
2-({4-methyl-5-[(naphthalen-1-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide
Compound characteristics
| Compound ID: | 8009-3889 |
| Compound Name: | 2-({4-methyl-5-[(naphthalen-1-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide |
| Molecular Weight: | 604.77 |
| Molecular Formula: | C29 H28 N6 O3 S3 |
| Smiles: | Cn1c(Cc2cccc3ccccc23)nnc1SCC(Nc1ccc2c(c1)sc(n2)SCC(N1CCOCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2554 |
| logD: | 4.2553 |
| logSw: | -4.3325 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.016 |
| InChI Key: | IQRACBCEOOZONR-UHFFFAOYSA-N |