2-{2-[5,5-dioxo-9-(propan-2-yl)-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl]acetamido}-N-propylbenzamide
Chemical Structure Depiction of
2-{2-[5,5-dioxo-9-(propan-2-yl)-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl]acetamido}-N-propylbenzamide
2-{2-[5,5-dioxo-9-(propan-2-yl)-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl]acetamido}-N-propylbenzamide
Compound characteristics
| Compound ID: | D289-0465 |
| Compound Name: | 2-{2-[5,5-dioxo-9-(propan-2-yl)-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl]acetamido}-N-propylbenzamide |
| Molecular Weight: | 491.61 |
| Molecular Formula: | C27 H29 N3 O4 S |
| Smiles: | CCCNC(c1ccccc1NC(CN1c2ccc(cc2c2ccccc2S1(=O)=O)C(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9768 |
| logD: | 4.9764 |
| logSw: | -4.4451 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.74 |
| InChI Key: | BNFRORPAXQUGER-UHFFFAOYSA-N |