N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide
Chemical Structure Depiction of
N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide
N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide
Compound characteristics
| Compound ID: | C798-1081 |
| Compound Name: | N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide |
| Molecular Weight: | 383.45 |
| Molecular Formula: | C17 H13 N5 O2 S2 |
| Smiles: | Cc1nnc(NC(CN2C(c3cccnc3Sc3ccccc23)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.5128 |
| logD: | 2.4564 |
| logSw: | -3.0362 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.954 |
| InChI Key: | XTTUPWWBFFHFHB-UHFFFAOYSA-N |