N-(1,3-benzothiazol-2-yl)-2-[(2-cyclopropyl-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(1,3-benzothiazol-2-yl)-2-[(2-cyclopropyl-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)sulfanyl]acetamide
N-(1,3-benzothiazol-2-yl)-2-[(2-cyclopropyl-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | G786-1738 |
| Compound Name: | N-(1,3-benzothiazol-2-yl)-2-[(2-cyclopropyl-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 454.53 |
| Molecular Formula: | C20 H18 N6 O3 S2 |
| Smiles: | CN1C(c2c(nc(C3CC3)nc2SCC(Nc2nc3ccccc3s2)=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0012 |
| logD: | 4.0012 |
| logSw: | -4.2525 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.218 |
| InChI Key: | MMQKAGLXTUEFQU-UHFFFAOYSA-N |