ethyl 4-amino-2-({[(1,3-benzothiazol-2-yl)sulfanyl]methyl}sulfanyl)pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-2-({[(1,3-benzothiazol-2-yl)sulfanyl]methyl}sulfanyl)pyrimidine-5-carboxylate
ethyl 4-amino-2-({[(1,3-benzothiazol-2-yl)sulfanyl]methyl}sulfanyl)pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 6456-0423 |
| Compound Name: | ethyl 4-amino-2-({[(1,3-benzothiazol-2-yl)sulfanyl]methyl}sulfanyl)pyrimidine-5-carboxylate |
| Molecular Weight: | 378.49 |
| Molecular Formula: | C15 H14 N4 O2 S3 |
| Smiles: | CCOC(c1cnc(nc1N)SCSc1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1086 |
| logD: | 4.1086 |
| logSw: | -4.2858 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.314 |
| InChI Key: | WUQOTAORNZVATK-UHFFFAOYSA-N |