methyl 2-[(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}furan-2-carbonyl)amino]-5-(propan-2-yl)-1,3-thiazole-4-carboxylate
Chemical Structure Depiction of
methyl 2-[(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}furan-2-carbonyl)amino]-5-(propan-2-yl)-1,3-thiazole-4-carboxylate
methyl 2-[(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}furan-2-carbonyl)amino]-5-(propan-2-yl)-1,3-thiazole-4-carboxylate
Compound characteristics
| Compound ID: | Y043-5275 |
| Compound Name: | methyl 2-[(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}furan-2-carbonyl)amino]-5-(propan-2-yl)-1,3-thiazole-4-carboxylate |
| Molecular Weight: | 446.55 |
| Molecular Formula: | C20 H22 N4 O4 S2 |
| Smiles: | CC(C)c1c(C(=O)OC)nc(NC(c2ccc(CSc3nc(C)cc(C)n3)o2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.5538 |
| logD: | 4.2886 |
| logSw: | -4.3187 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.796 |
| InChI Key: | VXOHYHQBLXTGGO-UHFFFAOYSA-N |