N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
Chemical Structure Depiction of
N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
Compound characteristics
| Compound ID: | Y031-6996 |
| Compound Name: | N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide |
| Molecular Weight: | 377.42 |
| Molecular Formula: | C15 H19 N7 O3 S |
| Smiles: | CCCCc1nnc(NC(Cn2cnc3c2C(N(C)C(N3C)=O)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 1.5772 |
| logD: | 1.4989 |
| logSw: | -2.1894 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.15 |
| InChI Key: | OBXWRMGQPUCPHD-UHFFFAOYSA-N |