2-{[8-(morpholine-4-sulfonyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}-N-[(thiophen-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{[8-(morpholine-4-sulfonyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}-N-[(thiophen-2-yl)methyl]acetamide
2-{[8-(morpholine-4-sulfonyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}-N-[(thiophen-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | K781-5822 |
| Compound Name: | 2-{[8-(morpholine-4-sulfonyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}-N-[(thiophen-2-yl)methyl]acetamide |
| Molecular Weight: | 504.61 |
| Molecular Formula: | C20 H20 N6 O4 S3 |
| Smiles: | C(c1cccs1)NC(CSc1nc2c(c3cc(ccc3[nH]2)S(N2CCOCC2)(=O)=O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5849 |
| logD: | 1.5849 |
| logSw: | -2.5963 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.644 |
| InChI Key: | QYJJZWULKJYQIK-UHFFFAOYSA-N |