N-benzyl-2-[(6-{[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-benzyl-2-[(6-{[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
N-benzyl-2-[(6-{[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | K615-0044 |
| Compound Name: | N-benzyl-2-[(6-{[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 578.71 |
| Molecular Formula: | C27 H30 N8 O3 S2 |
| Smiles: | C(c1ccccc1)NC(CSc1nc2ccc(cc2s1)Nc1nc(nc(n1)N1CCOCC1)N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4248 |
| logD: | 5.4233 |
| logSw: | -5.6539 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.009 |
| InChI Key: | GFOMPRYCYFJXKW-UHFFFAOYSA-N |